Literature DB >> 21522852

[μ-Bis(diphenyl-phosphan-yl)ethane-1:2κP:P']nona-carbonyl-1κC,2κC,3κC-(triphenyl-stibine-3κSb)-triangulo-triruthenium(0).

Omar Bin Shawkataly, Imthyaz Ahmed Khan, Siti Syaida Sirat, Chin Sing Yeap, Hoong-Kun Fun.   

Abstract

The asymmetric unit of the title triangulo-triruthenium compound, [Ru(3)(C(26)H(24)P(2))(C(18)H(15)Sb)(CO)(9)], consists of two crystallographically independent mol-ecules, A and B. The bis-(diphenyl-phosphan-yl)ethane ligand bridges an Ru-Ru bond and the monodentate stibine ligand bonds to the third Ru atom. Both the stibine and phosphine ligands are equatorial with respect to the Ru(3) triangle. Additionally, each Ru atom carries one equatorial and two axial terminal carbonyl ligands. The three stibine-substituted benzene rings make dihedral angles of 38.7 (3), 71.5 (3) and 70.0 (3)° with each other in mol-ecule A whereas these angles are 83.9 (3), 88.2 (3) and 56.8 (3)° in mol-ecule B. Similarly, the dihedral angles between the two benzene rings are 80.7 (3) and 87.6 (3)° for the two diphenyl-phosphanyl groups in mol-ecule A and 84.0 (3) and 72.6 (4)° in mol-ecule B. In the crystal, mol-ecules are linked into tetra-mers via inter-molecular C-H⋯O hydrogen bonds. Weak inter-molecular C-H⋯π inter-actions further stabilize the crystal structure.

Entities:  

Year:  2011        PMID: 21522852      PMCID: PMC3051588          DOI: 10.1107/S1600536810054218

Source DB:  PubMed          Journal:  Acta Crystallogr Sect E Struct Rep Online        ISSN: 1600-5368


Related literature

For general background to triangulo-triruthenium derivatives, see: Bruce et al. (1985 ▶, 1988a ▶,b ▶). For related structures, see: Shawkataly et al. (1998 ▶, 2004 ▶, 2010 ▶, 2011 ▶). For the synthesis of Ru3(CO)10(μ-Ph2PCH2CH2PPh2), see: Bruce et al. (1983 ▶). For the stability of the temperature controller used in the data collection, see: Cosier & Glazer (1986 ▶).

Experimental

Crystal data

[Ru3(C26H24P2)(C18H15Sb)(CO)9] M = 1306.74 Triclinic, a = 15.1589 (8) Å b = 18.6156 (10) Å c = 20.0398 (11) Å α = 113.233 (1)° β = 97.986 (1)° γ = 97.339 (1)° V = 5041.5 (5) Å3 Z = 4 Mo Kα radiation μ = 1.53 mm−1 T = 100 K 0.51 × 0.15 × 0.08 mm

Data collection

Bruker APEXII DUO CCD area-detector diffractometer Absorption correction: multi-scan (SADABS; Bruker, 2009 ▶) T min = 0.506, T max = 0.885 82542 measured reflections 28970 independent reflections 21778 reflections with I > 2σ(I) R int = 0.033

Refinement

R[F 2 > 2σ(F 2)] = 0.045 wR(F 2) = 0.121 S = 1.11 28970 reflections 1225 parameters H-atom parameters constrained Δρmax = 3.47 e Å−3 Δρmin = −2.34 e Å−3 Data collection: APEX2 (Bruker, 2009 ▶); cell refinement: SAINT (Bruker, 2009 ▶); data reduction: SAINT; program(s) used to solve structure: SHELXTL (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL and PLATON (Spek, 2009 ▶). Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536810054218/sj5087sup1.cif Structure factors: contains datablocks I. DOI: 10.1107/S1600536810054218/sj5087Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Ru3(C26H24P2)(C18H15Sb)(CO)9]Z = 4
Mr = 1306.74F(000) = 2568
Triclinic, P1Dx = 1.722 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 15.1589 (8) ÅCell parameters from 9952 reflections
b = 18.6156 (10) Åθ = 2.6–32.6°
c = 20.0398 (11) ŵ = 1.53 mm1
α = 113.233 (1)°T = 100 K
β = 97.986 (1)°Plate, brown
γ = 97.339 (1)°0.51 × 0.15 × 0.08 mm
V = 5041.5 (5) Å3
Bruker APEXII DUO CCD area-detector diffractometer28970 independent reflections
Radiation source: fine-focus sealed tube21778 reflections with I > 2σ(I)
graphiteRint = 0.033
φ and ω scansθmax = 30.0°, θmin = 1.9°
Absorption correction: multi-scan (SADABS; Bruker, 2009)h = −21→21
Tmin = 0.506, Tmax = 0.885k = −26→26
82542 measured reflectionsl = −28→28
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.045Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.121H-atom parameters constrained
S = 1.11w = 1/[σ2(Fo2) + (0.0352P)2 + 25.152P] where P = (Fo2 + 2Fc2)/3
28970 reflections(Δ/σ)max = 0.001
1225 parametersΔρmax = 3.47 e Å3
0 restraintsΔρmin = −2.34 e Å3
Experimental. The crystal was placed in the cold stream of an Oxford Cryosystems Cobra open-flow nitrogen cryostat (Cosier & Glazer, 1986) operating at 100.0 (1) K.
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.
xyzUiso*/Ueq
Sb1A−0.061486 (19)0.701152 (17)0.978302 (16)0.02093 (6)
Ru1A0.21003 (2)0.819388 (19)1.014099 (18)0.01705 (7)
Ru2A0.27903 (2)0.67570 (2)0.955200 (18)0.01778 (7)
Ru3A0.09780 (2)0.66624 (2)0.973168 (18)0.01816 (7)
P1A0.32886 (8)0.91401 (6)1.01639 (6)0.0191 (2)
P2A0.43433 (7)0.72287 (7)0.97737 (6)0.0196 (2)
O1A0.1010 (2)0.8075 (2)0.8671 (2)0.0351 (8)
O2A0.0940 (2)0.9232 (2)1.1051 (2)0.0333 (8)
O3A0.3215 (3)0.8307 (2)1.15895 (19)0.0348 (8)
O4A0.3109 (3)0.6504 (3)1.0984 (2)0.0448 (10)
O5A0.2593 (3)0.4989 (2)0.8596 (3)0.0493 (11)
O6A0.2524 (2)0.7124 (2)0.81825 (19)0.0318 (8)
O7A0.0570 (3)0.6188 (2)0.8050 (2)0.0382 (9)
O8A0.0677 (3)0.4919 (2)0.9450 (2)0.0409 (9)
O9A0.1349 (3)0.7158 (2)1.1413 (2)0.0375 (8)
C1A0.3020 (3)0.9671 (3)0.9585 (2)0.0224 (8)
C2A0.2874 (4)0.9255 (3)0.8817 (3)0.0299 (10)
H2AA0.29230.87220.86100.036*
C3A0.2655 (4)0.9632 (4)0.8352 (3)0.0402 (13)
H3AA0.25580.93500.78400.048*
C4A0.2585 (4)1.0422 (4)0.8656 (3)0.0421 (13)
H4AA0.24491.06750.83480.051*
C5A0.2714 (4)1.0842 (3)0.9420 (3)0.0377 (12)
H5AA0.26551.13720.96240.045*
C6A0.2934 (3)1.0465 (3)0.9879 (3)0.0314 (10)
H6AA0.30241.07481.03910.038*
C7A0.3792 (3)0.9948 (3)1.1076 (2)0.0229 (8)
C8A0.3235 (4)1.0310 (3)1.1547 (3)0.0338 (11)
H8AA0.26101.01191.13990.041*
C9A0.3581 (4)1.0945 (3)1.2230 (3)0.0397 (13)
H9AA0.31891.11811.25290.048*
C10A0.4501 (4)1.1227 (3)1.2466 (3)0.0388 (12)
H10A0.47351.16571.29230.047*
C11A0.5076 (4)1.0868 (3)1.2017 (3)0.0376 (12)
H11A0.57011.10501.21800.045*
C12A0.4734 (3)1.0240 (3)1.1330 (3)0.0299 (10)
H12A0.51311.00091.10330.036*
C13A0.4276 (3)0.8756 (3)0.9828 (2)0.0227 (8)
H13A0.40870.83900.93080.027*
H13B0.47290.91970.98690.027*
C14A0.4710 (3)0.8320 (3)1.0261 (2)0.0237 (9)
H14A0.45480.85001.07450.028*
H14B0.53670.84591.03390.028*
C15A0.4848 (3)0.6985 (3)0.8949 (2)0.0229 (8)
C16A0.4413 (3)0.6350 (3)0.8281 (3)0.0305 (10)
H16A0.38630.60440.82550.037*
C17A0.4782 (4)0.6165 (4)0.7650 (3)0.0387 (13)
H17A0.44890.57290.72120.046*
C18A0.5570 (4)0.6619 (4)0.7672 (3)0.0425 (14)
H18A0.58080.65010.72460.051*
C19A0.6022 (4)0.7259 (4)0.8329 (4)0.0453 (15)
H19A0.65620.75690.83440.054*
C20A0.5664 (4)0.7436 (3)0.8968 (3)0.0377 (12)
H20A0.59750.78580.94110.045*
C21A0.5025 (3)0.6893 (3)1.0373 (3)0.0254 (9)
C22A0.5174 (5)0.7281 (4)1.1142 (3)0.057 (2)
H22A0.49830.77601.13610.069*
C23A0.5599 (6)0.6968 (5)1.1585 (4)0.065 (2)
H23A0.56730.72321.20980.078*
C24A0.5911 (4)0.6284 (4)1.1292 (4)0.0468 (15)
H24A0.62100.60821.15970.056*
C25A0.5776 (5)0.5894 (4)1.0532 (4)0.0549 (18)
H25A0.59800.54201.03200.066*
C26A0.5344 (5)0.6194 (4)1.0083 (3)0.0478 (16)
H26A0.52640.59210.95700.057*
C27A−0.0963 (3)0.7794 (3)0.9286 (3)0.0244 (9)
C28A−0.1235 (4)0.7446 (3)0.8524 (3)0.0325 (10)
H28A−0.13230.68940.82720.039*
C29A−0.1381 (4)0.7898 (4)0.8122 (3)0.0385 (12)
H29A−0.15610.76500.76070.046*
C30A−0.1256 (4)0.8714 (4)0.8493 (3)0.0399 (13)
H30A−0.13540.90220.82310.048*
C31A−0.0984 (5)0.9073 (4)0.9262 (4)0.0467 (15)
H31A−0.08960.96240.95130.056*
C32A−0.0842 (4)0.8617 (3)0.9658 (3)0.0348 (11)
H32A−0.06650.88631.01730.042*
C33A−0.1068 (3)0.7415 (3)1.0806 (3)0.0264 (9)
C34A−0.0888 (4)0.8221 (3)1.1319 (3)0.0374 (12)
H34A−0.05800.86111.12080.045*
C35A−0.1168 (4)0.8437 (3)1.1990 (3)0.0396 (12)
H35A−0.10570.89711.23230.048*
C36A−0.1614 (4)0.7854 (4)1.2163 (3)0.0440 (14)
H36A−0.18330.79971.25990.053*
C37A−0.1725 (5)0.7078 (4)1.1692 (3)0.0508 (17)
H37A−0.19780.66841.18260.061*
C38A−0.1467 (5)0.6859 (3)1.1008 (3)0.0467 (15)
H38A−0.15710.63221.06850.056*
C39A−0.1726 (3)0.6039 (3)0.9140 (3)0.0265 (9)
C40A−0.1574 (3)0.5277 (3)0.8797 (3)0.0324 (11)
H40A−0.09820.51890.88280.039*
C41A−0.2300 (4)0.4641 (3)0.8404 (3)0.0388 (12)
H41A−0.21970.41260.81780.047*
C42A−0.3179 (4)0.4777 (3)0.8351 (3)0.0349 (11)
H42A−0.36680.43510.80940.042*
C43A−0.3330 (3)0.5543 (3)0.8678 (3)0.0368 (12)
H43A−0.39190.56340.86290.044*
C44A−0.2608 (3)0.6175 (3)0.9078 (3)0.0349 (11)
H44A−0.27120.66900.93050.042*
C45A0.2793 (3)0.8205 (3)1.1024 (3)0.0259 (9)
C46A0.1361 (3)0.8842 (3)1.0680 (2)0.0226 (8)
C47A0.1414 (3)0.8080 (3)0.9201 (3)0.0248 (9)
C48A0.2959 (3)0.6618 (3)1.0469 (3)0.0290 (10)
C49A0.2688 (3)0.5651 (3)0.8966 (3)0.0300 (10)
C50A0.2583 (3)0.7017 (3)0.8714 (2)0.0224 (8)
C51A0.0762 (3)0.6387 (3)0.8677 (2)0.0249 (9)
C52A0.0763 (3)0.5579 (3)0.9553 (3)0.0267 (9)
C53A0.1248 (3)0.6998 (3)1.0792 (3)0.0248 (9)
Sb1B0.591162 (19)0.322816 (17)0.539002 (15)0.01948 (6)
Ru1B0.32201 (2)0.19935 (2)0.497165 (19)0.02039 (7)
Ru2B0.24537 (2)0.33890 (2)0.55496 (2)0.02058 (7)
Ru3B0.42965 (2)0.35418 (2)0.542128 (18)0.01812 (7)
P1B0.21368 (9)0.10411 (7)0.50293 (7)0.0261 (2)
P2B0.09114 (8)0.28330 (7)0.52371 (7)0.0242 (2)
O1B0.2092 (2)0.1901 (2)0.3535 (2)0.0332 (8)
O2B0.4344 (3)0.0905 (2)0.4061 (2)0.0417 (9)
O3B0.4351 (3)0.2219 (2)0.6473 (2)0.0361 (8)
O4B0.2727 (3)0.2988 (2)0.6902 (2)0.0365 (8)
O5B0.2437 (3)0.5110 (3)0.6536 (3)0.0613 (14)
O6B0.2258 (3)0.3753 (3)0.4175 (3)0.0490 (11)
O7B0.3918 (2)0.2976 (2)0.37254 (19)0.0339 (8)
O8B0.4642 (3)0.5285 (2)0.5714 (2)0.0411 (9)
O9B0.4645 (3)0.4055 (2)0.7112 (2)0.0364 (8)
C1B0.1669 (3)0.0142 (3)0.4166 (3)0.0310 (10)
C2B0.1947 (3)0.0015 (3)0.3512 (3)0.0315 (10)
H2BA0.23790.04080.34970.038*
C3B0.1604 (4)−0.0680 (3)0.2873 (3)0.0397 (12)
H3BA0.1809−0.07520.24390.048*
C4B0.0965 (4)−0.1258 (4)0.2885 (3)0.0475 (15)
H4BA0.0719−0.17190.24540.057*
C5B0.0682 (4)−0.1159 (4)0.3538 (4)0.0485 (15)
H5BA0.0253−0.15580.35480.058*
C6B0.1035 (4)−0.0470 (3)0.4175 (3)0.0403 (13)
H6BA0.0851−0.04110.46140.048*
C7B0.2515 (4)0.0621 (3)0.5682 (3)0.0304 (10)
C8B0.3394 (4)0.0449 (3)0.5725 (3)0.0384 (12)
H8BA0.37640.05560.54280.046*
C9B0.3718 (5)0.0124 (4)0.6201 (3)0.0467 (15)
H9BA0.43020.00180.62260.056*
C10B0.3171 (6)−0.0041 (4)0.6639 (4)0.0557 (18)
H10B0.3389−0.02560.69620.067*
C11B0.2304 (5)0.0109 (5)0.6599 (4)0.0569 (18)
H11B0.1933−0.00190.68850.068*
C12B0.1974 (5)0.0454 (4)0.6130 (3)0.0447 (14)
H12B0.13950.05700.61190.054*
C13B0.1080 (4)0.1364 (3)0.5292 (3)0.0325 (11)
H13C0.06550.09070.52550.039*
H13D0.12220.17530.58050.039*
C14B0.0626 (3)0.1730 (3)0.4805 (3)0.0318 (10)
H14C−0.00280.15560.47070.038*
H14D0.08160.15340.43320.038*
C15B0.0242 (3)0.3097 (3)0.4569 (3)0.0284 (10)
C16B−0.0167 (4)0.3756 (3)0.4824 (3)0.0365 (11)
H16B−0.01330.40300.53310.044*
C17B−0.0626 (4)0.4012 (4)0.4335 (3)0.0442 (14)
H17B−0.08950.44540.45150.053*
C18B−0.0681 (4)0.3604 (4)0.3581 (3)0.0451 (15)
H18B−0.09930.37680.32500.054*
C19B−0.0273 (4)0.2955 (4)0.3321 (3)0.0454 (15)
H19B−0.03010.26870.28140.054*
C20B0.0180 (4)0.2699 (4)0.3809 (3)0.0406 (13)
H20B0.04450.22550.36250.049*
C21B0.0274 (3)0.3058 (3)0.5985 (3)0.0269 (9)
C22B0.0680 (4)0.3562 (4)0.6709 (3)0.0430 (14)
H22B0.12900.38060.68270.052*
C23B0.0178 (5)0.3708 (5)0.7267 (4)0.059 (2)
H23B0.04570.40510.77550.071*
C24B−0.0712 (5)0.3355 (5)0.7106 (4)0.0568 (19)
H24B−0.10370.34460.74830.068*
C25B−0.1140 (5)0.2854 (5)0.6371 (4)0.0548 (18)
H25B−0.17530.26200.62560.066*
C26B−0.0646 (4)0.2708 (4)0.5815 (3)0.0400 (13)
H26B−0.09300.23750.53260.048*
C27B0.6993 (3)0.4228 (3)0.6026 (2)0.0227 (8)
C28B0.7858 (4)0.4236 (3)0.5888 (4)0.0427 (14)
H28B0.79720.38090.54940.051*
C29B0.8555 (4)0.4873 (3)0.6331 (4)0.0478 (16)
H29B0.91380.48670.62360.057*
C30B0.8404 (3)0.5514 (3)0.6907 (3)0.0318 (10)
H30B0.88790.59400.72030.038*
C31B0.7536 (4)0.5520 (3)0.7043 (3)0.0375 (12)
H31B0.74240.59540.74320.045*
C32B0.6835 (4)0.4885 (3)0.6605 (3)0.0349 (11)
H32B0.62510.48960.66970.042*
C33B0.6441 (3)0.2765 (3)0.4407 (2)0.0217 (8)
C34B0.6234 (3)0.3025 (3)0.3861 (3)0.0263 (9)
H34B0.58000.33420.38940.032*
C35B0.6664 (4)0.2822 (3)0.3259 (3)0.0313 (10)
H35B0.65120.29950.28890.038*
C36B0.7323 (3)0.2358 (3)0.3216 (3)0.0289 (10)
H36B0.76210.22280.28210.035*
C37B0.7536 (3)0.2093 (3)0.3758 (3)0.0327 (11)
H37B0.79720.17780.37240.039*
C38B0.7100 (3)0.2292 (3)0.4359 (3)0.0320 (11)
H38B0.72470.21120.47240.038*
C39B0.6245 (3)0.2472 (3)0.5910 (2)0.0224 (8)
C40B0.6090 (4)0.1649 (3)0.5533 (3)0.0318 (10)
H40B0.58970.14100.50190.038*
C41B0.6220 (5)0.1176 (3)0.5918 (3)0.0429 (14)
H41B0.61210.06240.56610.052*
C42B0.6495 (4)0.1528 (4)0.6680 (3)0.0420 (13)
H42B0.65680.12110.69370.050*
C43B0.6664 (4)0.2347 (3)0.7063 (3)0.0345 (11)
H43B0.68590.25820.75770.041*
C44B0.6541 (3)0.2822 (3)0.6682 (3)0.0272 (9)
H44B0.66560.33750.69410.033*
C45B0.2505 (3)0.1991 (3)0.4099 (3)0.0248 (9)
C46B0.3946 (3)0.1328 (3)0.4428 (2)0.0265 (9)
C47B0.3945 (3)0.2181 (3)0.5931 (3)0.0265 (9)
C48B0.2661 (3)0.3111 (3)0.6383 (3)0.0269 (9)
C49B0.2434 (4)0.4467 (3)0.6153 (3)0.0353 (11)
C50B0.2353 (3)0.3600 (3)0.4666 (3)0.0323 (11)
C51B0.4029 (3)0.3167 (3)0.4355 (3)0.0246 (9)
C52B0.4522 (3)0.4623 (3)0.5594 (3)0.0262 (9)
C53B0.4480 (3)0.3832 (3)0.6477 (3)0.0251 (9)
U11U22U33U12U13U23
Sb1A0.01861 (13)0.02543 (14)0.02117 (13)0.00765 (11)0.00624 (10)0.01061 (11)
Ru1A0.01765 (15)0.01983 (15)0.01511 (14)0.00562 (12)0.00476 (12)0.00779 (12)
Ru2A0.01684 (15)0.02065 (15)0.01764 (15)0.00657 (12)0.00564 (12)0.00836 (12)
Ru3A0.01704 (15)0.02083 (15)0.01852 (15)0.00543 (12)0.00573 (12)0.00904 (12)
P1A0.0210 (5)0.0193 (5)0.0165 (5)0.0035 (4)0.0053 (4)0.0067 (4)
P2A0.0170 (5)0.0247 (5)0.0172 (5)0.0063 (4)0.0044 (4)0.0080 (4)
O1A0.0322 (19)0.047 (2)0.0255 (17)0.0062 (16)0.0008 (14)0.0161 (16)
O2A0.0356 (19)0.0302 (17)0.0361 (19)0.0141 (15)0.0184 (16)0.0101 (15)
O3A0.041 (2)0.043 (2)0.0249 (17)0.0106 (17)0.0008 (15)0.0198 (16)
O4A0.055 (3)0.063 (3)0.039 (2)0.028 (2)0.0200 (19)0.037 (2)
O5A0.052 (3)0.0236 (18)0.061 (3)0.0103 (18)0.016 (2)0.0041 (18)
O6A0.0326 (19)0.046 (2)0.0236 (16)0.0126 (16)0.0102 (14)0.0181 (15)
O7A0.0311 (19)0.054 (2)0.0235 (17)−0.0002 (17)0.0037 (15)0.0135 (17)
O8A0.045 (2)0.0284 (18)0.056 (3)0.0123 (17)0.0181 (19)0.0205 (18)
O9A0.041 (2)0.051 (2)0.0263 (18)0.0113 (18)0.0122 (16)0.0196 (17)
C1A0.020 (2)0.026 (2)0.024 (2)0.0015 (16)0.0035 (16)0.0140 (17)
C2A0.037 (3)0.032 (2)0.023 (2)0.008 (2)0.0072 (19)0.0124 (19)
C3A0.049 (3)0.052 (3)0.024 (2)0.016 (3)0.007 (2)0.020 (2)
C4A0.044 (3)0.054 (3)0.044 (3)0.017 (3)0.008 (3)0.035 (3)
C5A0.039 (3)0.034 (3)0.044 (3)0.008 (2)0.002 (2)0.022 (2)
C6A0.033 (3)0.033 (2)0.028 (2)0.005 (2)0.001 (2)0.014 (2)
C7A0.023 (2)0.023 (2)0.0193 (19)−0.0009 (16)0.0017 (16)0.0076 (16)
C8A0.029 (2)0.033 (3)0.027 (2)0.001 (2)0.007 (2)0.001 (2)
C9A0.038 (3)0.037 (3)0.030 (3)0.004 (2)0.009 (2)−0.001 (2)
C10A0.042 (3)0.031 (3)0.026 (2)−0.003 (2)0.001 (2)0.000 (2)
C11A0.031 (3)0.033 (3)0.034 (3)−0.004 (2)−0.001 (2)0.006 (2)
C12A0.026 (2)0.028 (2)0.029 (2)0.0025 (19)0.0050 (19)0.0064 (19)
C13A0.023 (2)0.023 (2)0.021 (2)0.0033 (16)0.0059 (16)0.0076 (16)
C14A0.021 (2)0.028 (2)0.0194 (19)0.0053 (17)0.0022 (16)0.0078 (17)
C15A0.022 (2)0.028 (2)0.024 (2)0.0109 (17)0.0079 (17)0.0135 (18)
C16A0.027 (2)0.041 (3)0.023 (2)0.012 (2)0.0096 (18)0.010 (2)
C17A0.042 (3)0.057 (3)0.025 (2)0.030 (3)0.015 (2)0.017 (2)
C18A0.061 (4)0.053 (3)0.042 (3)0.036 (3)0.036 (3)0.033 (3)
C19A0.046 (3)0.043 (3)0.063 (4)0.014 (3)0.037 (3)0.029 (3)
C20A0.040 (3)0.031 (3)0.045 (3)0.007 (2)0.022 (2)0.014 (2)
C21A0.019 (2)0.036 (2)0.025 (2)0.0095 (18)0.0063 (17)0.0139 (19)
C22A0.084 (5)0.064 (4)0.023 (3)0.047 (4)0.002 (3)0.010 (3)
C23A0.087 (6)0.084 (5)0.026 (3)0.047 (5)0.001 (3)0.021 (3)
C24A0.048 (4)0.063 (4)0.045 (3)0.024 (3)0.007 (3)0.036 (3)
C25A0.079 (5)0.056 (4)0.041 (3)0.039 (4)0.009 (3)0.026 (3)
C26A0.071 (4)0.050 (3)0.031 (3)0.036 (3)0.010 (3)0.018 (3)
C27A0.019 (2)0.033 (2)0.025 (2)0.0105 (18)0.0057 (17)0.0157 (19)
C28A0.038 (3)0.032 (2)0.027 (2)0.006 (2)0.006 (2)0.013 (2)
C29A0.043 (3)0.050 (3)0.028 (3)0.012 (3)0.008 (2)0.021 (2)
C30A0.045 (3)0.048 (3)0.041 (3)0.021 (3)0.008 (2)0.030 (3)
C31A0.064 (4)0.034 (3)0.045 (3)0.020 (3)0.006 (3)0.018 (3)
C32A0.044 (3)0.036 (3)0.029 (2)0.018 (2)0.005 (2)0.015 (2)
C33A0.028 (2)0.034 (2)0.025 (2)0.0155 (19)0.0118 (18)0.0158 (19)
C34A0.041 (3)0.032 (3)0.036 (3)0.004 (2)0.012 (2)0.011 (2)
C35A0.043 (3)0.038 (3)0.032 (3)0.007 (2)0.010 (2)0.009 (2)
C36A0.051 (4)0.052 (3)0.033 (3)0.010 (3)0.021 (3)0.017 (3)
C37A0.083 (5)0.038 (3)0.043 (3)0.008 (3)0.033 (3)0.024 (3)
C38A0.078 (5)0.031 (3)0.039 (3)0.014 (3)0.027 (3)0.016 (2)
C39A0.026 (2)0.035 (2)0.026 (2)0.0124 (19)0.0092 (18)0.0179 (19)
C40A0.022 (2)0.034 (3)0.039 (3)0.0036 (19)0.003 (2)0.014 (2)
C41A0.031 (3)0.030 (3)0.044 (3)0.004 (2)0.007 (2)0.006 (2)
C42A0.027 (2)0.040 (3)0.032 (3)−0.002 (2)0.001 (2)0.015 (2)
C43A0.019 (2)0.050 (3)0.042 (3)0.005 (2)0.004 (2)0.021 (3)
C44A0.023 (2)0.041 (3)0.040 (3)0.011 (2)0.004 (2)0.015 (2)
C45A0.030 (2)0.028 (2)0.026 (2)0.0105 (19)0.0085 (18)0.0158 (19)
C46A0.022 (2)0.026 (2)0.024 (2)0.0044 (17)0.0086 (17)0.0143 (17)
C47A0.022 (2)0.029 (2)0.023 (2)0.0057 (17)0.0050 (17)0.0096 (18)
C48A0.033 (3)0.033 (2)0.030 (2)0.015 (2)0.014 (2)0.018 (2)
C49A0.025 (2)0.029 (2)0.036 (3)0.0091 (19)0.009 (2)0.013 (2)
C50A0.018 (2)0.026 (2)0.022 (2)0.0044 (16)0.0044 (16)0.0094 (17)
C51A0.022 (2)0.027 (2)0.022 (2)−0.0015 (17)0.0039 (17)0.0084 (17)
C52A0.024 (2)0.029 (2)0.028 (2)0.0078 (18)0.0090 (18)0.0116 (19)
C53A0.023 (2)0.028 (2)0.024 (2)0.0048 (17)0.0056 (17)0.0113 (18)
Sb1B0.01926 (13)0.02293 (13)0.01749 (12)0.00678 (10)0.00551 (10)0.00843 (10)
Ru1B0.02591 (17)0.02054 (15)0.01923 (15)0.00768 (13)0.00992 (13)0.01034 (13)
Ru2B0.02011 (16)0.02150 (16)0.02397 (17)0.00693 (13)0.01028 (13)0.01081 (13)
Ru3B0.01884 (16)0.02118 (15)0.01860 (15)0.00665 (12)0.00762 (12)0.01070 (12)
P1B0.0347 (6)0.0212 (5)0.0257 (6)0.0054 (5)0.0161 (5)0.0101 (5)
P2B0.0210 (5)0.0293 (6)0.0229 (5)0.0038 (4)0.0088 (4)0.0106 (5)
O1B0.0322 (19)0.045 (2)0.0300 (18)0.0109 (16)0.0067 (15)0.0222 (16)
O2B0.038 (2)0.051 (2)0.033 (2)0.0233 (18)0.0120 (17)0.0094 (18)
O3B0.047 (2)0.0373 (19)0.0271 (18)0.0160 (17)0.0082 (16)0.0141 (16)
O4B0.039 (2)0.050 (2)0.0294 (18)0.0110 (17)0.0159 (16)0.0224 (17)
O5B0.064 (3)0.030 (2)0.077 (4)0.016 (2)0.020 (3)0.005 (2)
O6B0.037 (2)0.079 (3)0.062 (3)0.024 (2)0.018 (2)0.056 (3)
O7B0.0318 (19)0.047 (2)0.0248 (17)0.0002 (16)0.0077 (14)0.0189 (16)
O8B0.068 (3)0.0246 (17)0.040 (2)0.0158 (18)0.027 (2)0.0158 (16)
O9B0.039 (2)0.046 (2)0.0244 (17)0.0063 (17)0.0077 (15)0.0146 (16)
C1B0.030 (2)0.027 (2)0.032 (3)0.0026 (19)0.012 (2)0.008 (2)
C2B0.030 (2)0.035 (3)0.030 (2)0.007 (2)0.008 (2)0.013 (2)
C3B0.041 (3)0.041 (3)0.030 (3)0.011 (2)0.011 (2)0.006 (2)
C4B0.037 (3)0.039 (3)0.042 (3)0.001 (2)0.003 (2)−0.005 (3)
C5B0.044 (3)0.036 (3)0.048 (4)−0.002 (3)0.006 (3)0.004 (3)
C6B0.043 (3)0.033 (3)0.038 (3)−0.001 (2)0.014 (2)0.009 (2)
C7B0.044 (3)0.024 (2)0.026 (2)0.007 (2)0.013 (2)0.0115 (19)
C8B0.047 (3)0.034 (3)0.038 (3)0.014 (2)0.013 (2)0.016 (2)
C9B0.067 (4)0.041 (3)0.039 (3)0.028 (3)0.010 (3)0.019 (3)
C10B0.086 (5)0.054 (4)0.050 (4)0.033 (4)0.026 (4)0.035 (3)
C11B0.069 (5)0.081 (5)0.047 (4)0.023 (4)0.026 (3)0.047 (4)
C12B0.054 (4)0.049 (3)0.043 (3)0.018 (3)0.026 (3)0.024 (3)
C13B0.038 (3)0.025 (2)0.037 (3)0.004 (2)0.022 (2)0.012 (2)
C14B0.026 (2)0.031 (2)0.031 (2)−0.0012 (19)0.0082 (19)0.006 (2)
C15B0.022 (2)0.038 (3)0.024 (2)0.0003 (19)0.0054 (17)0.013 (2)
C16B0.038 (3)0.037 (3)0.031 (3)0.001 (2)0.000 (2)0.015 (2)
C17B0.050 (4)0.038 (3)0.046 (3)0.004 (3)0.001 (3)0.024 (3)
C18B0.033 (3)0.063 (4)0.040 (3)−0.013 (3)−0.006 (2)0.033 (3)
C19B0.029 (3)0.076 (4)0.028 (3)0.001 (3)0.002 (2)0.022 (3)
C20B0.027 (3)0.065 (4)0.028 (3)0.011 (3)0.008 (2)0.018 (3)
C21B0.025 (2)0.039 (3)0.028 (2)0.0136 (19)0.0134 (18)0.021 (2)
C22B0.030 (3)0.066 (4)0.031 (3)0.016 (3)0.013 (2)0.014 (3)
C23B0.056 (4)0.096 (6)0.032 (3)0.040 (4)0.022 (3)0.022 (3)
C24B0.056 (4)0.089 (5)0.060 (4)0.044 (4)0.045 (4)0.047 (4)
C25B0.040 (3)0.073 (5)0.069 (5)0.021 (3)0.036 (3)0.037 (4)
C26B0.031 (3)0.052 (3)0.044 (3)0.013 (2)0.017 (2)0.022 (3)
C27B0.0159 (19)0.030 (2)0.023 (2)0.0048 (16)0.0004 (16)0.0130 (18)
C28B0.027 (3)0.033 (3)0.054 (4)0.008 (2)0.010 (2)0.003 (2)
C29B0.023 (3)0.037 (3)0.067 (4)0.007 (2)0.012 (3)0.005 (3)
C30B0.024 (2)0.034 (3)0.031 (2)−0.0051 (19)−0.0015 (19)0.012 (2)
C31B0.036 (3)0.037 (3)0.027 (2)−0.002 (2)0.008 (2)0.002 (2)
C32B0.032 (3)0.036 (3)0.029 (2)0.002 (2)0.012 (2)0.005 (2)
C33B0.021 (2)0.025 (2)0.0202 (19)0.0062 (16)0.0057 (16)0.0090 (16)
C34B0.027 (2)0.025 (2)0.028 (2)0.0061 (18)0.0092 (18)0.0113 (18)
C35B0.034 (3)0.039 (3)0.024 (2)0.007 (2)0.012 (2)0.016 (2)
C36B0.028 (2)0.033 (2)0.021 (2)0.0016 (19)0.0107 (18)0.0058 (18)
C37B0.028 (2)0.040 (3)0.031 (2)0.016 (2)0.011 (2)0.012 (2)
C38B0.031 (3)0.046 (3)0.027 (2)0.019 (2)0.012 (2)0.018 (2)
C39B0.019 (2)0.030 (2)0.021 (2)0.0092 (17)0.0039 (16)0.0125 (17)
C40B0.038 (3)0.034 (2)0.023 (2)0.013 (2)0.006 (2)0.0096 (19)
C41B0.070 (4)0.027 (2)0.037 (3)0.022 (3)0.016 (3)0.014 (2)
C42B0.054 (4)0.050 (3)0.042 (3)0.026 (3)0.013 (3)0.034 (3)
C43B0.036 (3)0.045 (3)0.027 (2)0.009 (2)0.004 (2)0.020 (2)
C44B0.025 (2)0.030 (2)0.023 (2)0.0042 (18)0.0038 (17)0.0078 (18)
C45B0.021 (2)0.027 (2)0.033 (2)0.0066 (17)0.0129 (18)0.0172 (19)
C46B0.032 (2)0.031 (2)0.020 (2)0.0111 (19)0.0082 (18)0.0121 (18)
C47B0.033 (2)0.027 (2)0.023 (2)0.0099 (19)0.0088 (18)0.0110 (18)
C48B0.027 (2)0.028 (2)0.025 (2)0.0034 (18)0.0106 (18)0.0097 (18)
C49B0.027 (2)0.031 (3)0.046 (3)0.011 (2)0.011 (2)0.012 (2)
C50B0.024 (2)0.042 (3)0.046 (3)0.014 (2)0.015 (2)0.029 (2)
C51B0.021 (2)0.034 (2)0.026 (2)0.0069 (18)0.0094 (17)0.0168 (19)
C52B0.036 (3)0.028 (2)0.022 (2)0.0137 (19)0.0150 (19)0.0130 (18)
C53B0.025 (2)0.026 (2)0.027 (2)0.0069 (18)0.0097 (18)0.0125 (18)
Sb1A—C33A2.133 (4)Sb1B—C39B2.125 (4)
Sb1A—C39A2.133 (5)Sb1B—C27B2.132 (4)
Sb1A—C27A2.142 (5)Sb1B—C33B2.132 (4)
Sb1A—Ru3A2.5846 (4)Sb1B—Ru3B2.5919 (4)
Ru1A—C46A1.879 (4)Ru1B—C46B1.884 (4)
Ru1A—C45A1.919 (5)Ru1B—C45B1.923 (5)
Ru1A—C47A1.939 (5)Ru1B—C47B1.953 (5)
Ru1A—P1A2.3350 (12)Ru1B—P1B2.3073 (12)
Ru1A—Ru2A2.8651 (5)Ru1B—Ru3B2.8500 (5)
Ru1A—Ru3A2.8676 (5)Ru1B—Ru2B2.8655 (5)
Ru2A—C49A1.898 (5)Ru2B—C49B1.898 (5)
Ru2A—C50A1.919 (5)Ru2B—C48B1.932 (5)
Ru2A—C48A1.942 (5)Ru2B—C50B1.950 (5)
Ru2A—P2A2.3202 (12)Ru2B—P2B2.3224 (12)
Ru2A—Ru3A2.8124 (5)Ru2B—Ru3B2.8292 (5)
Ru3A—C52A1.880 (5)Ru3B—C52B1.879 (5)
Ru3A—C53A1.929 (5)Ru3B—C51B1.930 (5)
Ru3A—C51A1.936 (5)Ru3B—C53B1.935 (5)
P1A—C7A1.826 (4)P1B—C7B1.834 (5)
P1A—C1A1.835 (5)P1B—C1B1.836 (5)
P1A—C13A1.838 (4)P1B—C13B1.853 (5)
P2A—C21A1.820 (5)P2B—C15B1.826 (5)
P2A—C15A1.836 (4)P2B—C21B1.834 (4)
P2A—C14A1.839 (5)P2B—C14B1.850 (5)
O1A—C47A1.146 (6)O1B—C45B1.151 (6)
O2A—C46A1.145 (5)O2B—C46B1.146 (6)
O3A—C45A1.152 (6)O3B—C47B1.143 (6)
O4A—C48A1.131 (6)O4B—C48B1.145 (6)
O5A—C49A1.137 (6)O5B—C49B1.137 (6)
O6A—C50A1.153 (5)O6B—C50B1.125 (6)
O7A—C51A1.142 (6)O7B—C51B1.149 (5)
O8A—C52A1.148 (6)O8B—C52B1.143 (6)
O9A—C53A1.142 (6)O9B—C53B1.149 (6)
C1A—C6A1.389 (7)C1B—C2B1.374 (7)
C1A—C2A1.393 (6)C1B—C6B1.401 (7)
C2A—C3A1.399 (7)C2B—C3B1.385 (7)
C2A—H2AA0.9300C2B—H2BA0.9300
C3A—C4A1.376 (8)C3B—C4B1.363 (9)
C3A—H3AA0.9300C3B—H3BA0.9300
C4A—C5A1.388 (8)C4B—C5B1.386 (9)
C4A—H4AA0.9300C4B—H4BA0.9300
C5A—C6A1.391 (7)C5B—C6B1.380 (8)
C5A—H5AA0.9300C5B—H5BA0.9300
C6A—H6AA0.9300C6B—H6BA0.9300
C7A—C8A1.386 (6)C7B—C12B1.390 (7)
C7A—C12A1.406 (6)C7B—C8B1.409 (8)
C8A—C9A1.383 (7)C8B—C9B1.386 (8)
C8A—H8AA0.9300C8B—H8BA0.9300
C9A—C10A1.370 (8)C9B—C10B1.379 (9)
C9A—H9AA0.9300C9B—H9BA0.9300
C10A—C11A1.381 (8)C10B—C11B1.377 (10)
C10A—H10A0.9300C10B—H10B0.9300
C11A—C12A1.381 (7)C11B—C12B1.405 (9)
C11A—H11A0.9300C11B—H11B0.9300
C12A—H12A0.9300C12B—H12B0.9300
C13A—C14A1.542 (6)C13B—C14B1.532 (8)
C13A—H13A0.9700C13B—H13C0.9700
C13A—H13B0.9700C13B—H13D0.9700
C14A—H14A0.9700C14B—H14C0.9700
C14A—H14B0.9700C14B—H14D0.9700
C15A—C20A1.390 (7)C15B—C20B1.390 (7)
C15A—C16A1.390 (7)C15B—C16B1.391 (8)
C16A—C17A1.390 (6)C16B—C17B1.390 (8)
C16A—H16A0.9300C16B—H16B0.9300
C17A—C18A1.357 (9)C17B—C18B1.383 (9)
C17A—H17A0.9300C17B—H17B0.9300
C18A—C19A1.387 (9)C18B—C19B1.378 (10)
C18A—H18A0.9300C18B—H18B0.9300
C19A—C20A1.396 (7)C19B—C20B1.385 (8)
C19A—H19A0.9300C19B—H19B0.9300
C20A—H20A0.9300C20B—H20B0.9300
C21A—C26A1.381 (7)C21B—C22B1.376 (7)
C21A—C22A1.390 (7)C21B—C26B1.395 (7)
C22A—C23A1.373 (8)C22B—C23B1.398 (8)
C22A—H22A0.9300C22B—H22B0.9300
C23A—C24A1.355 (9)C23B—C24B1.357 (10)
C23A—H23A0.9300C23B—H23B0.9300
C24A—C25A1.376 (9)C24B—C25B1.398 (11)
C24A—H24A0.9300C24B—H24B0.9300
C25A—C26A1.370 (8)C25B—C26B1.386 (8)
C25A—H25A0.9300C25B—H25B0.9300
C26A—H26A0.9300C26B—H26B0.9300
C27A—C28A1.376 (7)C27B—C28B1.376 (7)
C27A—C32A1.388 (7)C27B—C32B1.389 (6)
C28A—C29A1.393 (7)C28B—C29B1.379 (8)
C28A—H28A0.9300C28B—H28B0.9300
C29A—C30A1.376 (8)C29B—C30B1.364 (8)
C29A—H29A0.9300C29B—H29B0.9300
C30A—C31A1.389 (8)C30B—C31B1.382 (7)
C30A—H30A0.9300C30B—H30B0.9300
C31A—C32A1.389 (8)C31B—C32B1.377 (7)
C31A—H31A0.9300C31B—H31B0.9300
C32A—H32A0.9300C32B—H32B0.9300
C33A—C38A1.357 (7)C33B—C34B1.374 (6)
C33A—C34A1.408 (7)C33B—C38B1.403 (6)
C34A—C35A1.387 (7)C34B—C35B1.395 (6)
C34A—H34A0.9300C34B—H34B0.9300
C35A—C36A1.390 (8)C35B—C36B1.391 (7)
C35A—H35A0.9300C35B—H35B0.9300
C36A—C37A1.350 (8)C36B—C37B1.377 (7)
C36A—H36A0.9300C36B—H36B0.9300
C37A—C38A1.396 (8)C37B—C38B1.398 (6)
C37A—H37A0.9300C37B—H37B0.9300
C38A—H38A0.9300C38B—H38B0.9300
C39A—C40A1.376 (7)C39B—C40B1.385 (7)
C39A—C44A1.390 (6)C39B—C44B1.398 (6)
C40A—C41A1.387 (7)C40B—C41B1.396 (7)
C40A—H40A0.9300C40B—H40B0.9300
C41A—C42A1.384 (7)C41B—C42B1.378 (8)
C41A—H41A0.9300C41B—H41B0.9300
C42A—C43A1.379 (8)C42B—C43B1.379 (8)
C42A—H42A0.9300C42B—H42B0.9300
C43A—C44A1.381 (8)C43B—C44B1.392 (7)
C43A—H43A0.9300C43B—H43B0.9300
C44A—H44A0.9300C44B—H44B0.9300
C33A—Sb1A—C39A98.08 (19)C39B—Sb1B—C27B98.51 (17)
C33A—Sb1A—C27A105.68 (17)C39B—Sb1B—C33B102.13 (16)
C39A—Sb1A—C27A97.20 (18)C27B—Sb1B—C33B97.89 (17)
C33A—Sb1A—Ru3A120.39 (13)C39B—Sb1B—Ru3B115.01 (12)
C39A—Sb1A—Ru3A115.03 (12)C27B—Sb1B—Ru3B114.69 (12)
C27A—Sb1A—Ru3A116.63 (12)C33B—Sb1B—Ru3B124.42 (12)
C46A—Ru1A—C45A92.10 (19)C46B—Ru1B—C45B93.28 (19)
C46A—Ru1A—C47A92.31 (19)C46B—Ru1B—C47B93.58 (19)
C45A—Ru1A—C47A174.59 (19)C45B—Ru1B—C47B170.68 (19)
C46A—Ru1A—P1A101.91 (14)C46B—Ru1B—P1B99.49 (15)
C45A—Ru1A—P1A88.87 (15)C45B—Ru1B—P1B93.42 (14)
C47A—Ru1A—P1A93.28 (14)C47B—Ru1B—P1B91.67 (15)
C46A—Ru1A—Ru2A154.44 (13)C46B—Ru1B—Ru3B102.02 (15)
C45A—Ru1A—Ru2A78.44 (14)C45B—Ru1B—Ru3B94.56 (14)
C47A—Ru1A—Ru2A96.26 (13)C47B—Ru1B—Ru3B77.83 (14)
P1A—Ru1A—Ru2A101.59 (3)P1B—Ru1B—Ru3B156.56 (3)
C46A—Ru1A—Ru3A98.87 (14)C46B—Ru1B—Ru2B157.28 (15)
C45A—Ru1A—Ru3A93.91 (15)C45B—Ru1B—Ru2B76.72 (13)
C47A—Ru1A—Ru3A82.31 (14)C47B—Ru1B—Ru2B94.62 (13)
P1A—Ru1A—Ru3A158.92 (3)P1B—Ru1B—Ru2B101.41 (3)
Ru2A—Ru1A—Ru3A58.759 (12)Ru3B—Ru1B—Ru2B59.339 (12)
C49A—Ru2A—C50A94.3 (2)C49B—Ru2B—C48B93.7 (2)
C49A—Ru2A—C48A92.3 (2)C49B—Ru2B—C50B91.1 (2)
C50A—Ru2A—C48A172.99 (19)C48B—Ru2B—C50B173.32 (19)
C49A—Ru2A—P2A101.77 (15)C49B—Ru2B—P2B100.33 (16)
C50A—Ru2A—P2A91.35 (13)C48B—Ru2B—P2B92.98 (14)
C48A—Ru2A—P2A89.58 (15)C50B—Ru2B—P2B90.74 (15)
C49A—Ru2A—Ru3A96.33 (15)C49B—Ru2B—Ru3B100.09 (16)
C50A—Ru2A—Ru3A95.05 (13)C48B—Ru2B—Ru3B94.22 (14)
C48A—Ru2A—Ru3A81.88 (15)C50B—Ru2B—Ru3B80.34 (14)
P2A—Ru2A—Ru3A160.28 (3)P2B—Ru2B—Ru3B157.84 (3)
C49A—Ru2A—Ru1A154.29 (15)C49B—Ru2B—Ru1B156.86 (16)
C50A—Ru2A—Ru1A77.77 (13)C48B—Ru2B—Ru1B77.34 (14)
C48A—Ru2A—Ru1A95.24 (14)C50B—Ru2B—Ru1B96.49 (15)
P2A—Ru2A—Ru1A102.82 (3)P2B—Ru2B—Ru1B101.39 (3)
Ru3A—Ru2A—Ru1A60.664 (11)Ru3B—Ru2B—Ru1B60.057 (12)
C52A—Ru3A—C53A92.0 (2)C52B—Ru3B—C51B93.8 (2)
C52A—Ru3A—C51A91.2 (2)C52B—Ru3B—C53B90.71 (19)
C53A—Ru3A—C51A176.3 (2)C51B—Ru3B—C53B174.62 (19)
C52A—Ru3A—Sb1A103.07 (14)C52B—Ru3B—Sb1B101.26 (15)
C53A—Ru3A—Sb1A90.78 (13)C51B—Ru3B—Sb1B90.55 (13)
C51A—Ru3A—Sb1A90.36 (14)C53B—Ru3B—Sb1B91.52 (13)
C52A—Ru3A—Ru2A95.94 (14)C52B—Ru3B—Ru2B98.10 (14)
C53A—Ru3A—Ru2A96.45 (13)C51B—Ru3B—Ru2B94.91 (13)
C51A—Ru3A—Ru2A81.31 (13)C53B—Ru3B—Ru2B81.48 (14)
Sb1A—Ru3A—Ru2A159.415 (17)Sb1B—Ru3B—Ru2B159.491 (17)
C52A—Ru3A—Ru1A154.47 (14)C52B—Ru3B—Ru1B156.09 (15)
C53A—Ru3A—Ru1A81.75 (14)C51B—Ru3B—Ru1B78.56 (14)
C51A—Ru3A—Ru1A94.55 (14)C53B—Ru3B—Ru1B96.16 (14)
Sb1A—Ru3A—Ru1A101.740 (14)Sb1B—Ru3B—Ru1B101.418 (15)
Ru2A—Ru3A—Ru1A60.576 (12)Ru2B—Ru3B—Ru1B60.604 (12)
C7A—P1A—C1A103.1 (2)C7B—P1B—C1B102.2 (2)
C7A—P1A—C13A103.4 (2)C7B—P1B—C13B103.6 (2)
C1A—P1A—C13A100.7 (2)C1B—P1B—C13B100.9 (2)
C7A—P1A—Ru1A115.41 (15)C7B—P1B—Ru1B115.21 (18)
C1A—P1A—Ru1A116.31 (15)C1B—P1B—Ru1B116.72 (16)
C13A—P1A—Ru1A115.84 (15)C13B—P1B—Ru1B116.02 (16)
C21A—P2A—C15A105.1 (2)C15B—P2B—C21B102.8 (2)
C21A—P2A—C14A102.0 (2)C15B—P2B—C14B103.2 (2)
C15A—P2A—C14A102.9 (2)C21B—P2B—C14B100.9 (2)
C21A—P2A—Ru2A114.15 (16)C15B—P2B—Ru2B114.64 (16)
C15A—P2A—Ru2A115.98 (16)C21B—P2B—Ru2B118.02 (17)
C14A—P2A—Ru2A115.03 (15)C14B—P2B—Ru2B115.19 (17)
C6A—C1A—C2A118.7 (4)C2B—C1B—C6B117.6 (5)
C6A—C1A—P1A122.8 (4)C2B—C1B—P1B123.1 (4)
C2A—C1A—P1A118.5 (4)C6B—C1B—P1B119.2 (4)
C1A—C2A—C3A120.6 (5)C1B—C2B—C3B122.0 (5)
C1A—C2A—H2AA119.7C1B—C2B—H2BA119.0
C3A—C2A—H2AA119.7C3B—C2B—H2BA119.0
C4A—C3A—C2A119.8 (5)C4B—C3B—C2B119.6 (5)
C4A—C3A—H3AA120.1C4B—C3B—H3BA120.2
C2A—C3A—H3AA120.1C2B—C3B—H3BA120.2
C3A—C4A—C5A120.4 (5)C3B—C4B—C5B120.0 (5)
C3A—C4A—H4AA119.8C3B—C4B—H4BA120.0
C5A—C4A—H4AA119.8C5B—C4B—H4BA120.0
C4A—C5A—C6A119.6 (5)C6B—C5B—C4B120.1 (6)
C4A—C5A—H5AA120.2C6B—C5B—H5BA120.0
C6A—C5A—H5AA120.2C4B—C5B—H5BA120.0
C1A—C6A—C5A121.0 (5)C5B—C6B—C1B120.6 (5)
C1A—C6A—H6AA119.5C5B—C6B—H6BA119.7
C5A—C6A—H6AA119.5C1B—C6B—H6BA119.7
C8A—C7A—C12A117.1 (4)C12B—C7B—C8B118.3 (5)
C8A—C7A—P1A119.9 (4)C12B—C7B—P1B123.4 (5)
C12A—C7A—P1A123.0 (3)C8B—C7B—P1B118.3 (4)
C9A—C8A—C7A122.0 (5)C9B—C8B—C7B121.2 (5)
C9A—C8A—H8AA119.0C9B—C8B—H8BA119.4
C7A—C8A—H8AA119.0C7B—C8B—H8BA119.4
C10A—C9A—C8A120.1 (5)C10B—C9B—C8B119.7 (6)
C10A—C9A—H9AA119.9C10B—C9B—H9BA120.1
C8A—C9A—H9AA119.9C8B—C9B—H9BA120.1
C9A—C10A—C11A119.3 (5)C11B—C10B—C9B120.3 (6)
C9A—C10A—H10A120.3C11B—C10B—H10B119.9
C11A—C10A—H10A120.3C9B—C10B—H10B119.9
C12A—C11A—C10A120.8 (5)C10B—C11B—C12B120.6 (6)
C12A—C11A—H11A119.6C10B—C11B—H11B119.7
C10A—C11A—H11A119.6C12B—C11B—H11B119.7
C11A—C12A—C7A120.6 (5)C7B—C12B—C11B119.9 (6)
C11A—C12A—H12A119.7C7B—C12B—H12B120.0
C7A—C12A—H12A119.7C11B—C12B—H12B120.0
C14A—C13A—P1A113.1 (3)C14B—C13B—P1B113.1 (3)
C14A—C13A—H13A109.0C14B—C13B—H13C109.0
P1A—C13A—H13A109.0P1B—C13B—H13C109.0
C14A—C13A—H13B109.0C14B—C13B—H13D109.0
P1A—C13A—H13B109.0P1B—C13B—H13D109.0
H13A—C13A—H13B107.8H13C—C13B—H13D107.8
C13A—C14A—P2A112.5 (3)C13B—C14B—P2B112.8 (4)
C13A—C14A—H14A109.1C13B—C14B—H14C109.0
P2A—C14A—H14A109.1P2B—C14B—H14C109.0
C13A—C14A—H14B109.1C13B—C14B—H14D109.0
P2A—C14A—H14B109.1P2B—C14B—H14D109.0
H14A—C14A—H14B107.8H14C—C14B—H14D107.8
C20A—C15A—C16A118.0 (4)C20B—C15B—C16B118.1 (5)
C20A—C15A—P2A121.3 (4)C20B—C15B—P2B122.2 (4)
C16A—C15A—P2A120.7 (4)C16B—C15B—P2B119.5 (4)
C17A—C16A—C15A121.3 (5)C17B—C16B—C15B121.4 (5)
C17A—C16A—H16A119.4C17B—C16B—H16B119.3
C15A—C16A—H16A119.4C15B—C16B—H16B119.3
C18A—C17A—C16A120.2 (6)C18B—C17B—C16B119.5 (6)
C18A—C17A—H17A119.9C18B—C17B—H17B120.3
C16A—C17A—H17A119.9C16B—C17B—H17B120.3
C17A—C18A—C19A120.1 (5)C19B—C18B—C17B119.9 (6)
C17A—C18A—H18A120.0C19B—C18B—H18B120.1
C19A—C18A—H18A120.0C17B—C18B—H18B120.1
C18A—C19A—C20A119.9 (5)C18B—C19B—C20B120.4 (6)
C18A—C19A—H19A120.0C18B—C19B—H19B119.8
C20A—C19A—H19A120.0C20B—C19B—H19B119.8
C15A—C20A—C19A120.5 (5)C19B—C20B—C15B120.8 (6)
C15A—C20A—H20A119.7C19B—C20B—H20B119.6
C19A—C20A—H20A119.7C15B—C20B—H20B119.6
C26A—C21A—C22A116.7 (5)C22B—C21B—C26B119.1 (5)
C26A—C21A—P2A121.2 (4)C22B—C21B—P2B121.8 (4)
C22A—C21A—P2A121.9 (4)C26B—C21B—P2B119.1 (4)
C23A—C22A—C21A121.1 (6)C21B—C22B—C23B120.3 (6)
C23A—C22A—H22A119.4C21B—C22B—H22B119.9
C21A—C22A—H22A119.4C23B—C22B—H22B119.9
C24A—C23A—C22A121.5 (6)C24B—C23B—C22B120.7 (6)
C24A—C23A—H23A119.3C24B—C23B—H23B119.6
C22A—C23A—H23A119.3C22B—C23B—H23B119.6
C23A—C24A—C25A118.2 (6)C23B—C24B—C25B119.8 (5)
C23A—C24A—H24A120.9C23B—C24B—H24B120.1
C25A—C24A—H24A120.9C25B—C24B—H24B120.1
C26A—C25A—C24A120.9 (6)C26B—C25B—C24B119.7 (6)
C26A—C25A—H25A119.5C26B—C25B—H25B120.1
C24A—C25A—H25A119.5C24B—C25B—H25B120.1
C25A—C26A—C21A121.5 (6)C25B—C26B—C21B120.4 (6)
C25A—C26A—H26A119.2C25B—C26B—H26B119.8
C21A—C26A—H26A119.2C21B—C26B—H26B119.8
C28A—C27A—C32A118.7 (5)C28B—C27B—C32B118.5 (5)
C28A—C27A—Sb1A115.7 (4)C28B—C27B—Sb1B121.6 (4)
C32A—C27A—Sb1A125.2 (4)C32B—C27B—Sb1B119.9 (3)
C27A—C28A—C29A121.8 (5)C27B—C28B—C29B120.4 (5)
C27A—C28A—H28A119.1C27B—C28B—H28B119.8
C29A—C28A—H28A119.1C29B—C28B—H28B119.8
C30A—C29A—C28A119.3 (5)C30B—C29B—C28B121.1 (5)
C30A—C29A—H29A120.3C30B—C29B—H29B119.5
C28A—C29A—H29A120.3C28B—C29B—H29B119.5
C29A—C30A—C31A119.5 (5)C29B—C30B—C31B119.1 (5)
C29A—C30A—H30A120.3C29B—C30B—H30B120.5
C31A—C30A—H30A120.3C31B—C30B—H30B120.5
C32A—C31A—C30A120.8 (5)C32B—C31B—C30B120.2 (5)
C32A—C31A—H31A119.6C32B—C31B—H31B119.9
C30A—C31A—H31A119.6C30B—C31B—H31B119.9
C27A—C32A—C31A119.9 (5)C31B—C32B—C27B120.6 (5)
C27A—C32A—H32A120.0C31B—C32B—H32B119.7
C31A—C32A—H32A120.0C27B—C32B—H32B119.7
C38A—C33A—C34A118.1 (5)C34B—C33B—C38B119.4 (4)
C38A—C33A—Sb1A118.1 (4)C34B—C33B—Sb1B119.4 (3)
C34A—C33A—Sb1A123.4 (4)C38B—C33B—Sb1B120.5 (3)
C35A—C34A—C33A120.3 (5)C33B—C34B—C35B121.0 (4)
C35A—C34A—H34A119.8C33B—C34B—H34B119.5
C33A—C34A—H34A119.8C35B—C34B—H34B119.5
C34A—C35A—C36A119.9 (5)C36B—C35B—C34B119.4 (5)
C34A—C35A—H35A120.0C36B—C35B—H35B120.3
C36A—C35A—H35A120.0C34B—C35B—H35B120.3
C37A—C36A—C35A119.4 (5)C37B—C36B—C35B120.1 (4)
C37A—C36A—H36A120.3C37B—C36B—H36B120.0
C35A—C36A—H36A120.3C35B—C36B—H36B120.0
C36A—C37A—C38A120.8 (5)C36B—C37B—C38B120.5 (5)
C36A—C37A—H37A119.6C36B—C37B—H37B119.8
C38A—C37A—H37A119.6C38B—C37B—H37B119.8
C33A—C38A—C37A121.2 (5)C37B—C38B—C33B119.5 (5)
C33A—C38A—H38A119.4C37B—C38B—H38B120.2
C37A—C38A—H38A119.4C33B—C38B—H38B120.2
C40A—C39A—C44A120.0 (5)C40B—C39B—C44B119.0 (4)
C40A—C39A—Sb1A120.3 (3)C40B—C39B—Sb1B123.0 (3)
C44A—C39A—Sb1A119.7 (4)C44B—C39B—Sb1B117.6 (3)
C39A—C40A—C41A120.2 (5)C39B—C40B—C41B120.5 (5)
C39A—C40A—H40A119.9C39B—C40B—H40B119.7
C41A—C40A—H40A119.9C41B—C40B—H40B119.7
C42A—C41A—C40A119.8 (5)C42B—C41B—C40B119.9 (5)
C42A—C41A—H41A120.1C42B—C41B—H41B120.1
C40A—C41A—H41A120.1C40B—C41B—H41B120.1
C43A—C42A—C41A120.1 (5)C41B—C42B—C43B120.4 (5)
C43A—C42A—H42A120.0C41B—C42B—H42B119.8
C41A—C42A—H42A120.0C43B—C42B—H42B119.8
C42A—C43A—C44A120.2 (5)C42B—C43B—C44B120.0 (5)
C42A—C43A—H43A119.9C42B—C43B—H43B120.0
C44A—C43A—H43A119.9C44B—C43B—H43B120.0
C43A—C44A—C39A119.8 (5)C43B—C44B—C39B120.2 (5)
C43A—C44A—H44A120.1C43B—C44B—H44B119.9
C39A—C44A—H44A120.1C39B—C44B—H44B119.9
O3A—C45A—Ru1A172.0 (4)O1B—C45B—Ru1B172.1 (4)
O2A—C46A—Ru1A175.3 (4)O2B—C46B—Ru1B175.8 (4)
O1A—C47A—Ru1A174.6 (4)O3B—C47B—Ru1B173.8 (4)
O4A—C48A—Ru2A174.6 (4)O4B—C48B—Ru2B173.6 (4)
O5A—C49A—Ru2A177.1 (5)O5B—C49B—Ru2B177.5 (6)
O6A—C50A—Ru2A172.8 (4)O6B—C50B—Ru2B175.6 (5)
O7A—C51A—Ru3A174.5 (4)O7B—C51B—Ru3B175.8 (4)
O8A—C52A—Ru3A176.7 (4)O8B—C52B—Ru3B178.0 (4)
O9A—C53A—Ru3A174.8 (4)O9B—C53B—Ru3B174.4 (4)
C46A—Ru1A—Ru2A—C49A60.7 (5)C46B—Ru1B—Ru2B—C49B−71.4 (6)
C45A—Ru1A—Ru2A—C49A130.7 (4)C45B—Ru1B—Ru2B—C49B−137.1 (5)
C47A—Ru1A—Ru2A—C49A−48.2 (4)C47B—Ru1B—Ru2B—C49B39.4 (5)
P1A—Ru1A—Ru2A—C49A−142.9 (4)P1B—Ru1B—Ru2B—C49B132.0 (5)
Ru3A—Ru1A—Ru2A—C49A28.9 (4)Ru3B—Ru1B—Ru2B—C49B−33.5 (5)
C46A—Ru1A—Ru2A—C50A134.8 (4)C46B—Ru1B—Ru2B—C48B−140.4 (4)
C45A—Ru1A—Ru2A—C50A−155.1 (2)C45B—Ru1B—Ru2B—C48B153.9 (2)
C47A—Ru1A—Ru2A—C50A25.95 (19)C47B—Ru1B—Ru2B—C48B−29.6 (2)
P1A—Ru1A—Ru2A—C50A−68.71 (14)P1B—Ru1B—Ru2B—C48B63.06 (15)
Ru3A—Ru1A—Ru2A—C50A103.01 (13)Ru3B—Ru1B—Ru2B—C48B−102.50 (15)
C46A—Ru1A—Ru2A—C48A−45.8 (4)C46B—Ru1B—Ru2B—C50B37.0 (4)
C45A—Ru1A—Ru2A—C48A24.2 (2)C45B—Ru1B—Ru2B—C50B−28.7 (2)
C47A—Ru1A—Ru2A—C48A−154.7 (2)C47B—Ru1B—Ru2B—C50B147.8 (2)
P1A—Ru1A—Ru2A—C48A110.64 (16)P1B—Ru1B—Ru2B—C50B−119.54 (16)
Ru3A—Ru1A—Ru2A—C48A−77.63 (16)Ru3B—Ru1B—Ru2B—C50B74.90 (16)
C46A—Ru1A—Ru2A—P2A−136.6 (3)C46B—Ru1B—Ru2B—P2B129.1 (4)
C45A—Ru1A—Ru2A—P2A−66.54 (15)C45B—Ru1B—Ru2B—P2B63.38 (13)
C47A—Ru1A—Ru2A—P2A114.54 (14)C47B—Ru1B—Ru2B—P2B−120.11 (15)
P1A—Ru1A—Ru2A—P2A19.88 (4)P1B—Ru1B—Ru2B—P2B−27.47 (5)
Ru3A—Ru1A—Ru2A—P2A−168.40 (3)Ru3B—Ru1B—Ru2B—P2B166.97 (3)
C46A—Ru1A—Ru2A—Ru3A31.8 (3)C46B—Ru1B—Ru2B—Ru3B−37.9 (4)
C45A—Ru1A—Ru2A—Ru3A101.86 (15)C45B—Ru1B—Ru2B—Ru3B−103.59 (13)
C47A—Ru1A—Ru2A—Ru3A−77.06 (14)C47B—Ru1B—Ru2B—Ru3B72.91 (14)
P1A—Ru1A—Ru2A—Ru3A−171.72 (3)P1B—Ru1B—Ru2B—Ru3B165.56 (4)
C33A—Sb1A—Ru3A—C52A88.6 (2)C39B—Sb1B—Ru3B—C52B140.72 (19)
C39A—Sb1A—Ru3A—C52A−28.4 (2)C27B—Sb1B—Ru3B—C52B27.51 (19)
C27A—Sb1A—Ru3A—C52A−141.3 (2)C33B—Sb1B—Ru3B—C52B−92.4 (2)
C33A—Sb1A—Ru3A—C53A−3.6 (2)C39B—Sb1B—Ru3B—C51B−125.34 (19)
C39A—Sb1A—Ru3A—C53A−120.60 (19)C27B—Sb1B—Ru3B—C51B121.45 (19)
C27A—Sb1A—Ru3A—C53A126.5 (2)C33B—Sb1B—Ru3B—C51B1.6 (2)
C33A—Sb1A—Ru3A—C51A179.9 (2)C39B—Sb1B—Ru3B—C53B49.70 (19)
C39A—Sb1A—Ru3A—C51A62.94 (19)C27B—Sb1B—Ru3B—C53B−63.52 (19)
C27A—Sb1A—Ru3A—C51A−50.0 (2)C33B—Sb1B—Ru3B—C53B176.6 (2)
C33A—Sb1A—Ru3A—Ru2A−114.47 (16)C39B—Sb1B—Ru3B—Ru2B−19.69 (14)
C39A—Sb1A—Ru3A—Ru2A128.56 (14)C27B—Sb1B—Ru3B—Ru2B−132.91 (14)
C27A—Sb1A—Ru3A—Ru2A15.66 (15)C33B—Sb1B—Ru3B—Ru2B107.22 (15)
C33A—Sb1A—Ru3A—Ru1A−85.37 (16)C39B—Sb1B—Ru3B—Ru1B−46.90 (13)
C39A—Sb1A—Ru3A—Ru1A157.66 (14)C27B—Sb1B—Ru3B—Ru1B−160.11 (13)
C27A—Sb1A—Ru3A—Ru1A44.77 (14)C33B—Sb1B—Ru3B—Ru1B80.02 (15)
C49A—Ru2A—Ru3A—C52A22.8 (2)C49B—Ru2B—Ru3B—C52B−24.3 (2)
C50A—Ru2A—Ru3A—C52A117.7 (2)C48B—Ru2B—Ru3B—C52B−118.8 (2)
C48A—Ru2A—Ru3A—C52A−68.7 (2)C50B—Ru2B—Ru3B—C52B65.1 (2)
P2A—Ru2A—Ru3A—C52A−133.87 (18)P2B—Ru2B—Ru3B—C52B132.58 (17)
Ru1A—Ru2A—Ru3A—C52A−169.41 (15)Ru1B—Ru2B—Ru3B—C52B168.44 (14)
C49A—Ru2A—Ru3A—C53A115.4 (2)C49B—Ru2B—Ru3B—C51B−118.8 (2)
C50A—Ru2A—Ru3A—C53A−149.66 (19)C48B—Ru2B—Ru3B—C51B146.7 (2)
C48A—Ru2A—Ru3A—C53A24.0 (2)C50B—Ru2B—Ru3B—C51B−29.4 (2)
P2A—Ru2A—Ru3A—C53A−41.19 (17)P2B—Ru2B—Ru3B—C51B38.07 (17)
Ru1A—Ru2A—Ru3A—C53A−76.73 (14)Ru1B—Ru2B—Ru3B—C51B73.93 (14)
C49A—Ru2A—Ru3A—C51A−67.6 (2)C49B—Ru2B—Ru3B—C53B65.2 (2)
C50A—Ru2A—Ru3A—C51A27.35 (19)C48B—Ru2B—Ru3B—C53B−29.3 (2)
C48A—Ru2A—Ru3A—C51A−159.0 (2)C50B—Ru2B—Ru3B—C53B154.6 (2)
P2A—Ru2A—Ru3A—C51A135.82 (17)P2B—Ru2B—Ru3B—C53B−137.92 (16)
Ru1A—Ru2A—Ru3A—C51A100.27 (14)Ru1B—Ru2B—Ru3B—C53B−102.06 (14)
C49A—Ru2A—Ru3A—Sb1A−134.69 (17)C49B—Ru2B—Ru3B—Sb1B136.30 (19)
C50A—Ru2A—Ru3A—Sb1A−39.78 (14)C48B—Ru2B—Ru3B—Sb1B41.82 (15)
C48A—Ru2A—Ru3A—Sb1A133.86 (16)C50B—Ru2B—Ru3B—Sb1B−134.28 (17)
P2A—Ru2A—Ru3A—Sb1A68.69 (11)P2B—Ru2B—Ru3B—Sb1B−66.82 (11)
Ru1A—Ru2A—Ru3A—Sb1A33.14 (5)Ru1B—Ru2B—Ru3B—Sb1B−30.96 (5)
C49A—Ru2A—Ru3A—Ru1A−167.83 (16)C49B—Ru2B—Ru3B—Ru1B167.26 (19)
C50A—Ru2A—Ru3A—Ru1A−72.93 (13)C48B—Ru2B—Ru3B—Ru1B72.77 (14)
C48A—Ru2A—Ru3A—Ru1A100.72 (15)C50B—Ru2B—Ru3B—Ru1B−103.32 (16)
P2A—Ru2A—Ru3A—Ru1A35.55 (9)P2B—Ru2B—Ru3B—Ru1B−35.86 (9)
C46A—Ru1A—Ru3A—C52A−141.6 (4)C46B—Ru1B—Ru3B—C52B136.6 (4)
C45A—Ru1A—Ru3A—C52A−48.9 (4)C45B—Ru1B—Ru3B—C52B42.3 (3)
C47A—Ru1A—Ru3A—C52A127.2 (4)C47B—Ru1B—Ru3B—C52B−132.2 (4)
P1A—Ru1A—Ru3A—C52A48.2 (3)P1B—Ru1B—Ru3B—C52B−67.2 (3)
Ru2A—Ru1A—Ru3A—C52A25.1 (3)Ru2B—Ru1B—Ru3B—C52B−29.3 (3)
C46A—Ru1A—Ru3A—C53A−64.46 (19)C46B—Ru1B—Ru3B—C51B63.6 (2)
C45A—Ru1A—Ru3A—C53A28.29 (19)C45B—Ru1B—Ru3B—C51B−30.74 (18)
C47A—Ru1A—Ru3A—C53A−155.60 (19)C47B—Ru1B—Ru3B—C51B154.71 (19)
P1A—Ru1A—Ru3A—C53A125.32 (16)P1B—Ru1B—Ru3B—C51B−140.27 (16)
Ru2A—Ru1A—Ru3A—C53A102.24 (14)Ru2B—Ru1B—Ru3B—C51B−102.37 (13)
C46A—Ru1A—Ru3A—C51A115.9 (2)C46B—Ru1B—Ru3B—C53B−117.4 (2)
C45A—Ru1A—Ru3A—C51A−151.31 (19)C45B—Ru1B—Ru3B—C53B148.22 (18)
C47A—Ru1A—Ru3A—C51A24.80 (19)C47B—Ru1B—Ru3B—C53B−26.33 (19)
P1A—Ru1A—Ru3A—C51A−54.28 (17)P1B—Ru1B—Ru3B—C53B38.69 (17)
Ru2A—Ru1A—Ru3A—C51A−77.36 (14)Ru2B—Ru1B—Ru3B—C53B76.60 (13)
C46A—Ru1A—Ru3A—Sb1A24.62 (14)C46B—Ru1B—Ru3B—Sb1B−24.63 (14)
C45A—Ru1A—Ru3A—Sb1A117.37 (13)C45B—Ru1B—Ru3B—Sb1B−118.97 (13)
C47A—Ru1A—Ru3A—Sb1A−66.52 (13)C47B—Ru1B—Ru3B—Sb1B66.48 (14)
P1A—Ru1A—Ru3A—Sb1A−145.60 (9)P1B—Ru1B—Ru3B—Sb1B131.50 (9)
Ru2A—Ru1A—Ru3A—Sb1A−168.678 (17)Ru2B—Ru1B—Ru3B—Sb1B169.406 (17)
C46A—Ru1A—Ru3A—Ru2A−166.70 (14)C46B—Ru1B—Ru3B—Ru2B165.96 (14)
C45A—Ru1A—Ru3A—Ru2A−73.95 (13)C45B—Ru1B—Ru3B—Ru2B71.62 (13)
C47A—Ru1A—Ru3A—Ru2A102.15 (13)C47B—Ru1B—Ru3B—Ru2B−102.93 (14)
P1A—Ru1A—Ru3A—Ru2A23.07 (9)P1B—Ru1B—Ru3B—Ru2B−37.91 (9)
C46A—Ru1A—P1A—C7A48.9 (2)C46B—Ru1B—P1B—C7B74.8 (2)
C45A—Ru1A—P1A—C7A−43.0 (2)C45B—Ru1B—P1B—C7B168.7 (2)
C47A—Ru1A—P1A—C7A141.9 (2)C47B—Ru1B—P1B—C7B−19.1 (2)
Ru2A—Ru1A—P1A—C7A−121.00 (17)Ru3B—Ru1B—P1B—C7B−81.6 (2)
Ru3A—Ru1A—P1A—C7A−141.00 (17)Ru2B—Ru1B—P1B—C7B−114.18 (17)
C46A—Ru1A—P1A—C1A−72.1 (2)C46B—Ru1B—P1B—C1B−45.1 (2)
C45A—Ru1A—P1A—C1A−164.1 (2)C45B—Ru1B—P1B—C1B48.8 (2)
C47A—Ru1A—P1A—C1A20.9 (2)C47B—Ru1B—P1B—C1B−139.0 (2)
Ru2A—Ru1A—P1A—C1A117.99 (16)Ru3B—Ru1B—P1B—C1B158.53 (19)
Ru3A—Ru1A—P1A—C1A97.98 (18)Ru2B—Ru1B—P1B—C1B125.9 (2)
C46A—Ru1A—P1A—C13A169.8 (2)C46B—Ru1B—P1B—C13B−163.9 (2)
C45A—Ru1A—P1A—C13A77.9 (2)C45B—Ru1B—P1B—C13B−70.0 (2)
C47A—Ru1A—P1A—C13A−97.1 (2)C47B—Ru1B—P1B—C13B102.2 (2)
Ru2A—Ru1A—P1A—C13A−0.03 (17)Ru3B—Ru1B—P1B—C13B39.8 (2)
Ru3A—Ru1A—P1A—C13A−20.0 (2)Ru2B—Ru1B—P1B—C13B7.1 (2)
C49A—Ru2A—P2A—C21A−68.3 (2)C49B—Ru2B—P2B—C15B72.9 (3)
C50A—Ru2A—P2A—C21A−163.0 (2)C48B—Ru2B—P2B—C15B167.2 (2)
C48A—Ru2A—P2A—C21A24.0 (2)C50B—Ru2B—P2B—C15B−18.4 (2)
Ru3A—Ru2A—P2A—C21A87.96 (19)Ru3B—Ru2B—P2B—C15B−84.0 (2)
Ru1A—Ru2A—P2A—C21A119.28 (17)Ru1B—Ru2B—P2B—C15B−115.14 (18)
C49A—Ru2A—P2A—C15A54.1 (2)C49B—Ru2B—P2B—C21B−48.4 (3)
C50A—Ru2A—P2A—C15A−40.5 (2)C48B—Ru2B—P2B—C21B45.8 (2)
C48A—Ru2A—P2A—C15A146.4 (2)C50B—Ru2B—P2B—C21B−139.7 (2)
Ru3A—Ru2A—P2A—C15A−149.62 (16)Ru3B—Ru2B—P2B—C21B154.70 (17)
Ru1A—Ru2A—P2A—C15A−118.30 (16)Ru1B—Ru2B—P2B—C21B123.51 (18)
C49A—Ru2A—P2A—C14A174.2 (2)C49B—Ru2B—P2B—C14B−167.6 (3)
C50A—Ru2A—P2A—C14A79.6 (2)C48B—Ru2B—P2B—C14B−73.3 (2)
C48A—Ru2A—P2A—C14A−93.5 (2)C50B—Ru2B—P2B—C14B101.1 (2)
Ru3A—Ru2A—P2A—C14A−29.5 (2)Ru3B—Ru2B—P2B—C14B35.6 (2)
Ru1A—Ru2A—P2A—C14A1.80 (16)Ru1B—Ru2B—P2B—C14B4.38 (19)
C7A—P1A—C1A—C6A−20.2 (4)C7B—P1B—C1B—C2B−125.4 (5)
C13A—P1A—C1A—C6A−126.8 (4)C13B—P1B—C1B—C2B127.9 (5)
Ru1A—P1A—C1A—C6A107.2 (4)Ru1B—P1B—C1B—C2B1.3 (5)
C7A—P1A—C1A—C2A161.4 (4)C7B—P1B—C1B—C6B50.9 (5)
C13A—P1A—C1A—C2A54.8 (4)C13B—P1B—C1B—C6B−55.8 (5)
Ru1A—P1A—C1A—C2A−71.2 (4)Ru1B—P1B—C1B—C6B177.5 (4)
C6A—C1A—C2A—C3A0.7 (7)C6B—C1B—C2B—C3B1.6 (8)
P1A—C1A—C2A—C3A179.1 (4)P1B—C1B—C2B—C3B177.9 (4)
C1A—C2A—C3A—C4A0.1 (9)C1B—C2B—C3B—C4B0.6 (9)
C2A—C3A—C4A—C5A−1.1 (9)C2B—C3B—C4B—C5B−2.0 (10)
C3A—C4A—C5A—C6A1.2 (9)C3B—C4B—C5B—C6B1.1 (10)
C2A—C1A—C6A—C5A−0.5 (7)C4B—C5B—C6B—C1B1.2 (10)
P1A—C1A—C6A—C5A−178.9 (4)C2B—C1B—C6B—C5B−2.5 (9)
C4A—C5A—C6A—C1A−0.4 (8)P1B—C1B—C6B—C5B−178.9 (5)
C1A—P1A—C7A—C8A84.7 (4)C1B—P1B—C7B—C12B−92.3 (5)
C13A—P1A—C7A—C8A−170.8 (4)C13B—P1B—C7B—C12B12.2 (5)
Ru1A—P1A—C7A—C8A−43.3 (5)Ru1B—P1B—C7B—C12B140.1 (4)
C1A—P1A—C7A—C12A−94.4 (4)C1B—P1B—C7B—C8B86.8 (4)
C13A—P1A—C7A—C12A10.2 (5)C13B—P1B—C7B—C8B−168.6 (4)
Ru1A—P1A—C7A—C12A137.7 (4)Ru1B—P1B—C7B—C8B−40.8 (4)
C12A—C7A—C8A—C9A1.8 (8)C12B—C7B—C8B—C9B−0.2 (8)
P1A—C7A—C8A—C9A−177.3 (5)P1B—C7B—C8B—C9B−179.4 (4)
C7A—C8A—C9A—C10A−1.2 (9)C7B—C8B—C9B—C10B0.5 (9)
C8A—C9A—C10A—C11A−0.5 (9)C8B—C9B—C10B—C11B0.5 (11)
C9A—C10A—C11A—C12A1.4 (9)C9B—C10B—C11B—C12B−1.9 (11)
C10A—C11A—C12A—C7A−0.8 (9)C8B—C7B—C12B—C11B−1.2 (9)
C8A—C7A—C12A—C11A−0.8 (8)P1B—C7B—C12B—C11B178.0 (5)
P1A—C7A—C12A—C11A178.2 (4)C10B—C11B—C12B—C7B2.2 (11)
C7A—P1A—C13A—C14A69.4 (3)C7B—P1B—C13B—C14B−179.1 (4)
C1A—P1A—C13A—C14A175.8 (3)C1B—P1B—C13B—C14B−73.6 (4)
Ru1A—P1A—C13A—C14A−57.8 (3)Ru1B—P1B—C13B—C14B53.5 (4)
P1A—C13A—C14A—P2A98.9 (3)P1B—C13B—C14B—P2B−97.8 (4)
C21A—P2A—C14A—C13A175.7 (3)C15B—P2B—C14B—C13B−177.1 (3)
C15A—P2A—C14A—C13A66.9 (3)C21B—P2B—C14B—C13B−71.0 (4)
Ru2A—P2A—C14A—C13A−60.2 (3)Ru2B—P2B—C14B—C13B57.2 (4)
C21A—P2A—C15A—C20A−75.2 (5)C21B—P2B—C15B—C20B−148.0 (4)
C14A—P2A—C15A—C20A31.2 (5)C14B—P2B—C15B—C20B−43.4 (5)
Ru2A—P2A—C15A—C20A157.7 (4)Ru2B—P2B—C15B—C20B82.6 (5)
C21A—P2A—C15A—C16A106.1 (4)C21B—P2B—C15B—C16B37.0 (5)
C14A—P2A—C15A—C16A−147.5 (4)C14B—P2B—C15B—C16B141.6 (4)
Ru2A—P2A—C15A—C16A−21.0 (4)Ru2B—P2B—C15B—C16B−92.3 (4)
C20A—C15A—C16A—C17A0.5 (7)C20B—C15B—C16B—C17B0.0 (8)
P2A—C15A—C16A—C17A179.3 (4)P2B—C15B—C16B—C17B175.2 (4)
C15A—C16A—C17A—C18A−1.8 (8)C15B—C16B—C17B—C18B0.2 (9)
C16A—C17A—C18A—C19A1.6 (8)C16B—C17B—C18B—C19B−0.7 (9)
C17A—C18A—C19A—C20A−0.1 (9)C17B—C18B—C19B—C20B1.1 (9)
C16A—C15A—C20A—C19A1.0 (8)C18B—C19B—C20B—C15B−0.9 (9)
P2A—C15A—C20A—C19A−177.7 (4)C16B—C15B—C20B—C19B0.3 (8)
C18A—C19A—C20A—C15A−1.2 (9)P2B—C15B—C20B—C19B−174.7 (4)
C15A—P2A—C21A—C26A−38.5 (5)C15B—P2B—C21B—C22B−125.0 (5)
C14A—P2A—C21A—C26A−145.6 (5)C14B—P2B—C21B—C22B128.6 (5)
Ru2A—P2A—C21A—C26A89.7 (5)Ru2B—P2B—C21B—C22B2.2 (5)
C15A—P2A—C21A—C22A147.9 (5)C15B—P2B—C21B—C26B55.0 (5)
C14A—P2A—C21A—C22A40.8 (6)C14B—P2B—C21B—C26B−51.3 (5)
Ru2A—P2A—C21A—C22A−83.9 (6)Ru2B—P2B—C21B—C26B−177.7 (4)
C26A—C21A—C22A—C23A−1.6 (11)C26B—C21B—C22B—C23B1.2 (9)
P2A—C21A—C22A—C23A172.3 (7)P2B—C21B—C22B—C23B−178.7 (5)
C21A—C22A—C23A—C24A1.9 (14)C21B—C22B—C23B—C24B0.2 (11)
C22A—C23A—C24A—C25A−1.4 (13)C22B—C23B—C24B—C25B−1.5 (11)
C23A—C24A—C25A—C26A0.6 (12)C23B—C24B—C25B—C26B1.4 (11)
C24A—C25A—C26A—C21A−0.3 (12)C24B—C25B—C26B—C21B0.0 (10)
C22A—C21A—C26A—C25A0.8 (10)C22B—C21B—C26B—C25B−1.3 (9)
P2A—C21A—C26A—C25A−173.1 (6)P2B—C21B—C26B—C25B178.6 (5)
C33A—Sb1A—C27A—C28A−143.9 (4)C39B—Sb1B—C27B—C28B78.7 (5)
C39A—Sb1A—C27A—C28A−43.4 (4)C33B—Sb1B—C27B—C28B−24.9 (5)
Ru3A—Sb1A—C27A—C28A79.3 (4)Ru3B—Sb1B—C27B—C28B−158.7 (4)
C33A—Sb1A—C27A—C32A43.4 (5)C39B—Sb1B—C27B—C32B−100.1 (4)
C39A—Sb1A—C27A—C32A143.9 (4)C33B—Sb1B—C27B—C32B156.3 (4)
Ru3A—Sb1A—C27A—C32A−93.3 (4)Ru3B—Sb1B—C27B—C32B22.5 (4)
C32A—C27A—C28A—C29A0.6 (8)C32B—C27B—C28B—C29B2.1 (9)
Sb1A—C27A—C28A—C29A−172.5 (4)Sb1B—C27B—C28B—C29B−176.8 (5)
C27A—C28A—C29A—C30A−0.4 (8)C27B—C28B—C29B—C30B−1.1 (11)
C28A—C29A—C30A—C31A0.3 (9)C28B—C29B—C30B—C31B−0.1 (10)
C29A—C30A—C31A—C32A−0.4 (10)C29B—C30B—C31B—C32B0.3 (9)
C28A—C27A—C32A—C31A−0.7 (8)C30B—C31B—C32B—C27B0.7 (9)
Sb1A—C27A—C32A—C31A171.8 (4)C28B—C27B—C32B—C31B−1.9 (8)
C30A—C31A—C32A—C27A0.6 (9)Sb1B—C27B—C32B—C31B177.0 (4)
C39A—Sb1A—C33A—C38A39.5 (5)C39B—Sb1B—C33B—C34B170.1 (4)
C27A—Sb1A—C33A—C38A139.3 (5)C27B—Sb1B—C33B—C34B−89.4 (4)
Ru3A—Sb1A—C33A—C38A−85.9 (5)Ru3B—Sb1B—C33B—C34B37.9 (4)
C39A—Sb1A—C33A—C34A−147.6 (4)C39B—Sb1B—C33B—C38B−19.3 (4)
C27A—Sb1A—C33A—C34A−47.7 (5)C27B—Sb1B—C33B—C38B81.2 (4)
Ru3A—Sb1A—C33A—C34A87.0 (4)Ru3B—Sb1B—C33B—C38B−151.5 (3)
C38A—C33A—C34A—C35A−4.1 (9)C38B—C33B—C34B—C35B0.4 (7)
Sb1A—C33A—C34A—C35A−177.0 (4)Sb1B—C33B—C34B—C35B171.1 (4)
C33A—C34A—C35A—C36A1.2 (9)C33B—C34B—C35B—C36B−1.0 (8)
C34A—C35A—C36A—C37A3.6 (10)C34B—C35B—C36B—C37B1.1 (8)
C35A—C36A—C37A—C38A−5.3 (11)C35B—C36B—C37B—C38B−0.7 (8)
C34A—C33A—C38A—C37A2.4 (10)C36B—C37B—C38B—C33B0.1 (8)
Sb1A—C33A—C38A—C37A175.7 (5)C34B—C33B—C38B—C37B0.0 (8)
C36A—C37A—C38A—C33A2.4 (11)Sb1B—C33B—C38B—C37B−170.6 (4)
C33A—Sb1A—C39A—C40A−122.7 (4)C27B—Sb1B—C39B—C40B−146.7 (4)
C27A—Sb1A—C39A—C40A130.3 (4)C33B—Sb1B—C39B—C40B−46.7 (4)
Ru3A—Sb1A—C39A—C40A6.4 (4)Ru3B—Sb1B—C39B—C40B90.9 (4)
C33A—Sb1A—C39A—C44A56.4 (4)C27B—Sb1B—C39B—C44B40.5 (4)
C27A—Sb1A—C39A—C44A−50.6 (4)C33B—Sb1B—C39B—C44B140.5 (3)
Ru3A—Sb1A—C39A—C44A−174.5 (4)Ru3B—Sb1B—C39B—C44B−81.9 (4)
C44A—C39A—C40A—C41A−1.7 (8)C44B—C39B—C40B—C41B0.4 (7)
Sb1A—C39A—C40A—C41A177.4 (4)Sb1B—C39B—C40B—C41B−172.2 (4)
C39A—C40A—C41A—C42A0.9 (9)C39B—C40B—C41B—C42B0.7 (9)
C40A—C41A—C42A—C43A0.9 (9)C40B—C41B—C42B—C43B−1.5 (9)
C41A—C42A—C43A—C44A−1.9 (9)C41B—C42B—C43B—C44B1.1 (9)
C42A—C43A—C44A—C39A1.1 (8)C42B—C43B—C44B—C39B0.1 (8)
C40A—C39A—C44A—C43A0.7 (8)C40B—C39B—C44B—C43B−0.9 (7)
Sb1A—C39A—C44A—C43A−178.4 (4)Sb1B—C39B—C44B—C43B172.2 (4)
Cg1, Cg2 and Cg3 are the centroids of the C21B–C26B, C39B–C44B and C15A–C20A benzene rings, respectively.
D—H···AD—HH···AD···AD—H···A
C18A—H18A···O7Bi0.932.553.337 (7)142
C34A—H34A···O2A0.932.563.375 (7)147
C34B—H34B···O8Bi0.932.573.414 (7)151
C5B—H5BA···Cg1ii0.933.003.723 (9)136
C25B—H25B···Cg2iii0.932.953.856 (8)166
C43A—H43A···Cg3iii0.932.913.624 (6)135
Table 1

Hydrogen-bond geometry (Å, °)

Cg1, Cg2 and Cg3 are the centroids of the C21B–C26B, C39B–C44B and C15A–C20A benzene rings, respectively.

D—H⋯AD—HH⋯ADAD—H⋯A
C18A—H18A⋯O7Bi0.932.553.337 (7)142
C34A—H34A⋯O2A0.932.563.375 (7)147
C34B—H34B⋯O8Bi0.932.573.414 (7)151
C5B—H5BACg1ii0.933.003.723 (9)136
C25B—H25BCg2iii0.932.953.856 (8)166
C43A—H43ACg3iii0.932.913.624 (6)135

Symmetry codes: (i) ; (ii) ; (iii) .

  4 in total

1.  A short history of SHELX.

Authors:  George M Sheldrick
Journal:  Acta Crystallogr A       Date:  2007-12-21       Impact factor: 2.290

2.  [μ-Bis(diphenyl-arsino)methane-1:2κAs:As']nona-carbonyl-1κC,2κC,3κC-[triphenyl-stibine-3κSb]-triangulo-triruthenium(0).

Authors:  Omar Bin Shawkataly; Imthyaz Ahmed Khan; Chin Sing Yeap; Hoong-Kun Fun
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2009-12-24

3.  [μ-Bis(diphenyl-phosphan-yl)ethane-1:2κP:P']nona-carbonyl-1κC,2κC,3κC-[tris-(4-(meth-oxy-phen-yl)arsane-3κAs]-triangulo-triruthenium(0) chloro-form monosolvate.

Authors:  Omar Bin Shawkataly; Imthyaz Ahmed Khan; Siti Syaida Sirat; Chin Sing Yeap; Hoong-Kun Fun
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2011-01-15

4.  Structure validation in chemical crystallography.

Authors:  Anthony L Spek
Journal:  Acta Crystallogr D Biol Crystallogr       Date:  2009-01-20
  4 in total

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