Literature DB >> 21577465

{1,1'-[(2,2-Dimethyl-propane-1,3-di-yl)bis-(nitrilo-methyl-idyne)]di-2-naphthol-ato}dioxidomolybdenum(VI) dichloro-methane 1.75-solvate.

Niaz Monadi, Iran Sheikhshoaie, Abdoreza Rezaeifard, Helen Stoeckli-Evans.   

Abstract

In the crystal structure of the title compound, [Mo(C(27)H(24)N(2)O(2))O(2)]·1.75CH(2)Cl(2), the Mo(VI) ion is coordinated by two oxide O atoms and by two O and two N atoms of the tetra-dentate 1,1'-[(2,2-dimethyl-propane-1,3-di-yl)bis-(nitrilo-methyl-idyne)]di-2-naphtholate Schiff base ligand in a distorted octa-hedral configuration. The compound crystallizes with 1.75 mol-ecules of dichloro-methane per complex mol-ecule. In the crystal, symmetry-related mol-ecules are linked by a number of C-H⋯O inter-actions involving both the Schiff base ligand and the partly disordered dichloro-methane solvent mol-ecules, leading to the formation of a two-dimensional network extending parallel to (101).

Entities:  

Year:  2009        PMID: 21577465      PMCID: PMC2969995          DOI: 10.1107/S1600536809032759

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


Related literature

For the chemistry of molybdenum(VI)Schiff base complexes and related structures with O=Mo=O units (metal oxidation state +VI), see: Abbasi et al. (2008 ▶); Arnaiz et al. (2000 ▶); Holm et al. (1996 ▶); Maurya et al. (1997 ▶); Nakayima et al. (1998 ▶); Rao et al. (1998 ▶); Sheikhshoaie et al. (2009 ▶); Syamal & Maurya (1989 ▶).

Experimental

Crystal data

[Mo(C27H24N2O2)O2]·1.75CH2Cl2 M = 685.04 Monoclinic, a = 27.6049 (18) Å b = 10.7743 (8) Å c = 21.6474 (14) Å β = 112.861 (7)° V = 5932.7 (7) Å3 Z = 8 Mo Kα radiation μ = 0.79 mm−1 T = 173 K 0.38 × 0.23 × 0.18 mm

Data collection

Stoe IPDS diffractometer Absorption correction: multi-scan (MULscanABS in PLATON; Spek, 2009 ▶) T min = 0.833, T max = 0.864 21863 measured reflections 5537 independent reflections 4789 reflections with I > 2σ(I) R int = 0.024

Refinement

R[F 2 > 2σ(F 2)] = 0.035 wR(F 2) = 0.106 S = 1.12 5537 reflections 372 parameters H-atom parameters constrained Δρmax = 1.08 e Å−3 Δρmin = −0.83 e Å−3 Data collection: EXPOSE in IPDS-I (Stoe & Cie, 2000 ▶); cell refinement: CELL in IPDS-I (Stoe & Cie, 2000 ▶); data reduction: INTEGRATE in IPDS-I (Stoe & Cie, 2000 ▶); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: PLATON (Spek, 2009 ▶) and Mercury (Macrae et al., 2006 ▶); software used to prepare material for publication: SHELXL97. Crystal structure: contains datablocks I, global. DOI: 10.1107/S1600536809032759/wm2248sup1.cif Structure factors: contains datablocks I. DOI: 10.1107/S1600536809032759/wm2248Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Mo(C27H24N2O2)O2]·1.75CH2Cl2F(000) = 2780
Mr = 685.04Dx = 1.534 Mg m3
Monoclinic, C2/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -C 2ycCell parameters from 7998 reflections
a = 27.6049 (18) Åθ = 2.0–26.1°
b = 10.7743 (8) ŵ = 0.79 mm1
c = 21.6474 (14) ÅT = 173 K
β = 112.861 (7)°Block, red
V = 5932.7 (7) Å30.38 × 0.23 × 0.18 mm
Z = 8
Stoe IPDS diffractometer5537 independent reflections
Radiation source: fine-focus sealed tube4789 reflections with I > 2σ(I)
graphiteRint = 0.024
φ rotation scansθmax = 26.0°, θmin = 2.2°
Absorption correction: multi-scan (MULscanABS in PLATON; Spek, 2009)h = −33→33
Tmin = 0.833, Tmax = 0.864k = −13→13
21863 measured reflectionsl = −26→26
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.035Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.106H-atom parameters constrained
S = 1.12w = 1/[σ2(Fo2) + (0.0575P)2 + 13.6226P] where P = (Fo2 + 2Fc2)/3
5537 reflections(Δ/σ)max = 0.001
372 parametersΔρmax = 1.08 e Å3
0 restraintsΔρmin = −0.83 e Å3
Geometry. Bond distances, angles etc. have been calculated using the rounded fractional coordinates. All su's are estimated from the variances of the (full) variance-covariance matrix. The cell e.s.d.'s are taken into account in the estimation of distances, angles and torsion angles
xyzUiso*/UeqOcc. (<1)
Mo10.15195 (1)0.99201 (2)0.16605 (1)0.0203 (1)
O10.11880 (7)0.83854 (17)0.10537 (10)0.0244 (5)
O20.07965 (7)1.05359 (17)0.13420 (10)0.0243 (5)
O30.17351 (8)1.04666 (19)0.10747 (10)0.0294 (6)
O40.18137 (8)1.08694 (18)0.23387 (10)0.0292 (6)
N10.21210 (9)0.8581 (2)0.20744 (11)0.0230 (7)
N20.11991 (9)0.8840 (2)0.23353 (11)0.0226 (6)
C10.14254 (11)0.7716 (2)0.07556 (14)0.0240 (8)
C20.11155 (12)0.7170 (3)0.01261 (15)0.0320 (9)
C30.13435 (13)0.6494 (3)−0.02156 (16)0.0351 (9)
C40.18908 (13)0.6260 (3)0.00395 (15)0.0297 (9)
C50.21229 (15)0.5592 (3)−0.03334 (16)0.0359 (10)
C60.26506 (15)0.5380 (3)−0.00885 (17)0.0378 (10)
C70.29652 (14)0.5838 (3)0.05388 (18)0.0373 (10)
C80.27554 (13)0.6506 (3)0.09176 (16)0.0312 (9)
C90.22085 (12)0.6729 (2)0.06788 (14)0.0258 (8)
C100.19693 (11)0.7471 (2)0.10402 (14)0.0240 (8)
C110.22523 (11)0.7765 (2)0.17248 (14)0.0236 (8)
C120.23835 (11)0.8489 (3)0.28089 (14)0.0259 (8)
C130.20409 (11)0.7852 (3)0.31281 (14)0.0264 (8)
C140.15487 (11)0.8626 (3)0.30383 (14)0.0265 (8)
C150.07193 (11)0.8512 (2)0.21471 (14)0.0243 (8)
C160.03019 (11)0.8852 (3)0.15189 (14)0.0237 (8)
C17−0.01851 (11)0.8180 (3)0.12751 (14)0.0258 (8)
C18−0.02482 (13)0.7013 (3)0.15323 (16)0.0317 (9)
C19−0.07116 (14)0.6372 (3)0.12614 (18)0.0396 (11)
C20−0.11356 (13)0.6855 (3)0.07190 (19)0.0412 (11)
C21−0.10943 (12)0.7981 (3)0.04577 (16)0.0347 (9)
C22−0.06213 (11)0.8663 (3)0.07250 (15)0.0277 (8)
C23−0.05656 (12)0.9810 (3)0.04395 (16)0.0311 (9)
C24−0.00985 (11)1.0411 (3)0.06555 (15)0.0276 (8)
C250.03480 (11)0.9914 (2)0.11817 (15)0.0231 (8)
C260.18840 (13)0.6549 (3)0.28459 (17)0.0347 (9)
C270.23717 (13)0.7789 (3)0.38843 (15)0.0342 (9)
Cl1A0.11134 (12)0.36651 (18)0.28031 (10)0.1016 (8)0.800
Cl20.06716 (6)0.14580 (16)0.31642 (8)0.0913 (6)
C280.0768 (2)0.2286 (5)0.2529 (2)0.0657 (17)
Cl1B0.0605 (5)0.3839 (7)0.2649 (4)0.102 (4)0.200
Cl30.02059 (6)0.4230 (2)0.09019 (10)0.0919 (8)0.750
Cl40.13068 (6)0.4167 (3)0.11352 (11)0.0993 (8)0.750
C290.0693 (3)0.3744 (8)0.0643 (4)0.088 (3)0.750
H20.074500.72800−0.005600.0380*
H30.112800.61660−0.064200.0420*
H50.190700.52830−0.076400.0430*
H60.280200.49240−0.034400.0450*
H70.333300.568800.071000.0450*
H80.298000.681900.134300.0370*
H110.257000.732200.195100.0280*
H12A0.247500.933300.299900.0310*
H12B0.271500.801500.292400.0310*
H14A0.134800.819500.326700.0320*
H14B0.166200.943800.326100.0320*
H150.062800.800300.244400.0290*
H180.003600.666700.190000.0380*
H19−0.074500.559000.144400.0480*
H20−0.145400.639800.053200.0490*
H21−0.138600.830900.009300.0420*
H23−0.086101.016400.009100.0370*
H24−0.006901.117400.045300.0330*
H26A0.220100.605300.292900.0520*
H26B0.167800.659900.236200.0520*
H26C0.167200.615600.306500.0520*
H27A0.268500.728000.396500.0510*
H27B0.247900.862900.405700.0510*
H27C0.216200.741900.411300.0510*
H28A0.096200.175600.232900.0790*0.800
H28B0.042100.247800.217300.0790*0.800
H28C0.112400.217500.255300.0790*0.200
H28D0.052300.201200.209200.0790*0.200
H29A0.068100.282700.061000.1060*0.750
H29B0.061400.407400.018700.1060*0.750
U11U22U33U12U13U23
Mo10.0189 (1)0.0204 (1)0.0216 (1)−0.0010 (1)0.0080 (1)−0.0015 (1)
O10.0227 (9)0.0256 (9)0.0249 (10)−0.0011 (7)0.0092 (8)−0.0046 (7)
O20.0215 (9)0.0231 (9)0.0287 (10)0.0001 (7)0.0103 (8)0.0010 (8)
O30.0272 (10)0.0320 (11)0.0308 (11)−0.0018 (8)0.0133 (9)0.0012 (8)
O40.0278 (10)0.0257 (10)0.0315 (11)−0.0013 (8)0.0086 (9)−0.0053 (8)
N10.0193 (11)0.0271 (12)0.0220 (11)0.0005 (9)0.0074 (9)−0.0015 (9)
N20.0246 (11)0.0235 (11)0.0205 (11)0.0036 (9)0.0097 (10)0.0005 (9)
C10.0292 (14)0.0198 (12)0.0249 (13)−0.0016 (10)0.0127 (12)0.0000 (10)
C20.0312 (15)0.0290 (15)0.0301 (15)0.0010 (12)0.0058 (13)−0.0057 (12)
C30.0465 (18)0.0275 (15)0.0261 (15)−0.0007 (13)0.0086 (14)−0.0046 (11)
C40.0446 (17)0.0215 (13)0.0280 (14)−0.0004 (12)0.0196 (14)0.0005 (11)
C50.060 (2)0.0229 (14)0.0318 (16)−0.0016 (13)0.0254 (16)−0.0004 (12)
C60.062 (2)0.0243 (14)0.0428 (18)0.0024 (14)0.0375 (18)0.0004 (13)
C70.0467 (19)0.0271 (15)0.0501 (19)0.0051 (13)0.0318 (17)0.0059 (13)
C80.0372 (16)0.0276 (14)0.0352 (16)0.0024 (12)0.0212 (14)0.0019 (12)
C90.0358 (15)0.0181 (12)0.0290 (14)0.0015 (11)0.0186 (13)0.0029 (10)
C100.0277 (14)0.0205 (12)0.0243 (13)−0.0003 (10)0.0107 (12)0.0001 (10)
C110.0215 (13)0.0247 (13)0.0278 (14)0.0021 (10)0.0132 (12)0.0015 (10)
C120.0224 (13)0.0310 (14)0.0203 (13)0.0046 (11)0.0038 (11)−0.0023 (11)
C130.0263 (14)0.0291 (14)0.0221 (13)0.0048 (11)0.0077 (12)−0.0005 (11)
C140.0271 (14)0.0318 (14)0.0206 (13)0.0033 (11)0.0094 (12)0.0012 (11)
C150.0267 (14)0.0241 (13)0.0257 (14)0.0008 (10)0.0141 (12)0.0019 (10)
C160.0222 (13)0.0257 (13)0.0243 (13)0.0024 (10)0.0104 (11)−0.0016 (10)
C170.0267 (14)0.0285 (14)0.0252 (14)−0.0004 (11)0.0133 (12)−0.0051 (11)
C180.0350 (16)0.0318 (15)0.0327 (16)−0.0036 (12)0.0180 (14)−0.0024 (12)
C190.0454 (19)0.0353 (17)0.0453 (19)−0.0133 (14)0.0254 (17)−0.0073 (14)
C200.0330 (17)0.0463 (19)0.0472 (19)−0.0173 (14)0.0188 (16)−0.0143 (15)
C210.0243 (14)0.0477 (18)0.0331 (16)−0.0042 (13)0.0121 (13)−0.0106 (14)
C220.0216 (13)0.0359 (15)0.0274 (14)−0.0016 (11)0.0116 (12)−0.0072 (12)
C230.0238 (14)0.0383 (16)0.0279 (15)0.0042 (12)0.0065 (13)−0.0009 (12)
C240.0261 (14)0.0284 (14)0.0283 (14)0.0043 (11)0.0106 (12)0.0036 (11)
C250.0209 (13)0.0230 (13)0.0263 (14)0.0011 (10)0.0101 (12)−0.0035 (10)
C260.0378 (17)0.0294 (15)0.0369 (17)0.0023 (13)0.0145 (14)0.0008 (12)
C270.0332 (16)0.0433 (18)0.0248 (15)0.0124 (13)0.0097 (13)0.0043 (12)
Cl1A0.150 (2)0.0683 (11)0.0748 (11)−0.0216 (12)0.0309 (13)−0.0188 (9)
Cl20.0686 (8)0.1124 (12)0.0813 (9)0.0082 (8)0.0163 (7)0.0270 (8)
C280.067 (3)0.073 (3)0.064 (3)−0.009 (2)0.033 (2)−0.027 (2)
Cl1B0.166 (9)0.060 (4)0.073 (4)0.011 (5)0.040 (5)−0.022 (3)
Cl30.0444 (8)0.150 (2)0.0799 (12)0.0113 (10)0.0225 (8)−0.0222 (12)
Cl40.0402 (8)0.157 (2)0.0875 (13)0.0037 (10)0.0105 (8)0.0133 (13)
C290.057 (4)0.114 (6)0.100 (6)−0.009 (4)0.038 (4)−0.048 (5)
Mo1—O12.0888 (19)C18—C191.369 (5)
Mo1—O21.957 (2)C19—C201.397 (5)
Mo1—O31.702 (2)C20—C211.362 (5)
Mo1—O41.713 (2)C21—C221.412 (5)
Mo1—N12.118 (2)C22—C231.417 (5)
Mo1—N22.297 (2)C23—C241.354 (5)
Cl1A—C281.741 (6)C24—C251.419 (4)
Cl1B—C281.778 (10)C2—H20.9500
Cl2—C281.744 (5)C3—H30.9500
Cl3—C291.727 (9)C5—H50.9500
Cl4—C291.677 (9)C6—H60.9500
O1—C11.302 (3)C7—H70.9500
O2—C251.330 (4)C8—H80.9500
N1—C121.472 (4)C11—H110.9500
N1—C111.300 (4)C12—H12A0.9900
N2—C141.470 (4)C12—H12B0.9900
N2—C151.275 (4)C14—H14B0.9900
C1—C101.409 (4)C14—H14A0.9900
C1—C21.425 (4)C15—H150.9500
C2—C31.355 (5)C18—H180.9500
C3—C41.415 (5)C19—H190.9500
C4—C51.408 (5)C20—H200.9500
C4—C91.413 (4)C21—H210.9500
C5—C61.362 (6)C23—H230.9500
C6—C71.388 (5)C24—H240.9500
C7—C81.377 (5)C26—H26C0.9800
C8—C91.413 (5)C26—H26B0.9800
C9—C101.445 (4)C26—H26A0.9800
C10—C111.417 (4)C27—H27A0.9800
C12—C131.533 (4)C27—H27B0.9800
C13—C261.525 (5)C27—H27C0.9800
C13—C271.535 (4)C28—H28A0.9900
C13—C141.541 (5)C28—H28D0.9700
C15—C161.447 (4)C28—H28B0.9900
C16—C251.389 (4)C28—H28C0.9700
C16—C171.435 (5)C29—H29A0.9900
C17—C181.413 (5)C29—H29B0.9900
C17—C221.423 (4)
O1—Mo1—O284.79 (8)C1—C2—H2120.00
O1—Mo1—O390.00 (9)C3—C2—H2120.00
O1—Mo1—O4163.25 (9)C2—C3—H3119.00
O1—Mo1—N178.85 (8)C4—C3—H3119.00
O1—Mo1—N279.39 (8)C4—C5—H5119.00
O2—Mo1—O3102.96 (10)C6—C5—H5119.00
O2—Mo1—O4100.28 (10)C5—C6—H6120.00
O2—Mo1—N1154.77 (9)C7—C6—H6120.00
O2—Mo1—N278.68 (9)C6—C7—H7119.00
O3—Mo1—O4104.21 (10)C8—C7—H7119.00
O3—Mo1—N196.16 (10)C7—C8—H8120.00
O3—Mo1—N2169.12 (9)C9—C8—H8120.00
O4—Mo1—N190.65 (9)N1—C11—H11117.00
O4—Mo1—N285.92 (9)C10—C11—H11117.00
N1—Mo1—N279.52 (9)N1—C12—H12A109.00
Mo1—O1—C1124.64 (18)N1—C12—H12B109.00
Mo1—O2—C25129.78 (16)C13—C12—H12A109.00
Mo1—N1—C11124.36 (19)C13—C12—H12B109.00
Mo1—N1—C12118.61 (18)H12A—C12—H12B108.00
C11—N1—C12116.8 (2)N2—C14—H14A109.00
Mo1—N2—C14118.55 (19)N2—C14—H14B109.00
Mo1—N2—C15123.10 (18)C13—C14—H14A109.00
C14—N2—C15118.0 (2)C13—C14—H14B109.00
O1—C1—C2118.2 (3)H14A—C14—H14B108.00
O1—C1—C10122.9 (2)N2—C15—H15117.00
C2—C1—C10118.9 (3)C16—C15—H15117.00
C1—C2—C3120.7 (3)C17—C18—H18119.00
C2—C3—C4122.3 (3)C19—C18—H18119.00
C3—C4—C5121.5 (3)C18—C19—H19120.00
C3—C4—C9118.7 (3)C20—C19—H19120.00
C5—C4—C9119.8 (3)C19—C20—H20120.00
C4—C5—C6121.3 (3)C21—C20—H20120.00
C5—C6—C7119.3 (3)C20—C21—H21120.00
C6—C7—C8121.4 (4)C22—C21—H21120.00
C7—C8—C9120.5 (3)C22—C23—H23119.00
C4—C9—C8117.8 (3)C24—C23—H23119.00
C4—C9—C10119.2 (3)C23—C24—H24120.00
C8—C9—C10122.9 (3)C25—C24—H24120.00
C1—C10—C9120.0 (3)C13—C26—H26A110.00
C1—C10—C11118.5 (3)C13—C26—H26B110.00
C9—C10—C11120.5 (3)C13—C26—H26C109.00
N1—C11—C10126.5 (3)H26A—C26—H26B109.00
N1—C12—C13112.7 (2)H26A—C26—H26C109.00
C12—C13—C14111.7 (3)H26B—C26—H26C109.00
C12—C13—C26111.1 (3)C13—C27—H27A109.00
C12—C13—C27106.6 (3)C13—C27—H27B109.00
C14—C13—C26110.4 (3)C13—C27—H27C109.00
C14—C13—C27106.8 (2)H27A—C27—H27B109.00
C26—C13—C27110.2 (3)H27A—C27—H27C110.00
N2—C14—C13114.1 (2)H27B—C27—H27C109.00
N2—C15—C16125.4 (3)Cl1A—C28—Cl2113.5 (2)
C15—C16—C17120.5 (3)Cl1B—C28—Cl2104.0 (4)
C15—C16—C25120.0 (3)Cl1A—C28—H28A109.00
C17—C16—C25119.1 (3)Cl1A—C28—H28B109.00
C16—C17—C18123.1 (3)Cl2—C28—H28A109.00
C16—C17—C22119.4 (3)Cl2—C28—H28B109.00
C18—C17—C22117.5 (3)Cl2—C28—H28C111.00
C17—C18—C19121.2 (3)Cl2—C28—H28D111.00
C18—C19—C20120.7 (3)Cl1B—C28—H28C115.00
C19—C20—C21120.2 (3)Cl1B—C28—H28D108.00
C20—C21—C22120.5 (3)H28A—C28—H28B108.00
C17—C22—C21120.0 (3)H28C—C28—H28D109.00
C17—C22—C23119.0 (3)Cl3—C29—Cl4115.7 (5)
C21—C22—C23121.0 (3)Cl3—C29—H29A109.00
C22—C23—C24121.1 (3)Cl3—C29—H29B108.00
C23—C24—C25120.7 (3)Cl4—C29—H29A108.00
O2—C25—C16123.0 (3)Cl4—C29—H29B108.00
O2—C25—C24116.7 (2)H29A—C29—H29B107.00
C16—C25—C24120.3 (3)
O2—Mo1—O1—C1149.5 (2)C9—C4—C5—C60.4 (5)
O3—Mo1—O1—C146.5 (2)C3—C4—C9—C8−178.7 (3)
N1—Mo1—O1—C1−49.8 (2)C3—C4—C9—C10−2.4 (4)
N2—Mo1—O1—C1−131.1 (2)C5—C4—C9—C80.3 (4)
O1—Mo1—O2—C2533.1 (2)C5—C4—C9—C10176.6 (3)
O3—Mo1—O2—C25121.9 (2)C4—C5—C6—C7−0.4 (5)
O4—Mo1—O2—C25−130.7 (2)C5—C6—C7—C8−0.3 (5)
N1—Mo1—O2—C25−16.4 (4)C6—C7—C8—C90.9 (5)
N2—Mo1—O2—C25−47.1 (2)C7—C8—C9—C4−0.9 (4)
O1—Mo1—N1—C1137.9 (2)C7—C8—C9—C10−177.1 (3)
O1—Mo1—N1—C12−137.0 (2)C4—C9—C10—C10.2 (4)
O2—Mo1—N1—C1188.4 (3)C4—C9—C10—C11168.5 (3)
O2—Mo1—N1—C12−86.5 (3)C8—C9—C10—C1176.3 (3)
O3—Mo1—N1—C11−50.9 (2)C8—C9—C10—C11−15.4 (4)
O3—Mo1—N1—C12134.2 (2)C1—C10—C11—N1−23.9 (4)
O4—Mo1—N1—C11−155.3 (2)C9—C10—C11—N1167.7 (3)
O4—Mo1—N1—C1229.9 (2)N1—C12—C13—C14−65.6 (3)
N2—Mo1—N1—C11119.0 (2)N1—C12—C13—C2658.2 (3)
N2—Mo1—N1—C12−55.9 (2)N1—C12—C13—C27178.2 (2)
O1—Mo1—N2—C14131.0 (2)C12—C13—C14—N260.7 (3)
O1—Mo1—N2—C15−55.5 (2)C26—C13—C14—N2−63.5 (3)
O2—Mo1—N2—C14−142.3 (2)C27—C13—C14—N2176.8 (3)
O2—Mo1—N2—C1531.3 (2)N2—C15—C16—C17163.0 (3)
O4—Mo1—N2—C14−40.9 (2)N2—C15—C16—C25−23.8 (4)
O4—Mo1—N2—C15132.6 (2)C15—C16—C17—C18−14.9 (5)
N1—Mo1—N2—C1450.5 (2)C15—C16—C17—C22168.7 (3)
N1—Mo1—N2—C15−136.0 (2)C25—C16—C17—C18171.9 (3)
Mo1—O1—C1—C2−147.8 (2)C25—C16—C17—C22−4.6 (4)
Mo1—O1—C1—C1034.8 (3)C15—C16—C25—O212.1 (4)
Mo1—O2—C25—C1635.8 (4)C15—C16—C25—C24−165.6 (3)
Mo1—O2—C25—C24−146.5 (2)C17—C16—C25—O2−174.6 (3)
Mo1—N1—C11—C10−11.9 (4)C17—C16—C25—C247.7 (4)
C12—N1—C11—C10163.0 (3)C16—C17—C18—C19−176.5 (3)
Mo1—N1—C12—C1375.1 (3)C22—C17—C18—C190.1 (5)
C11—N1—C12—C13−100.2 (3)C16—C17—C22—C21176.7 (3)
Mo1—N2—C14—C13−61.8 (3)C16—C17—C22—C23−1.1 (5)
C15—N2—C14—C13124.3 (3)C18—C17—C22—C210.1 (5)
Mo1—N2—C15—C16−5.7 (4)C18—C17—C22—C23−177.8 (3)
C14—N2—C15—C16167.9 (3)C17—C18—C19—C200.3 (6)
O1—C1—C2—C3178.1 (3)C18—C19—C20—C21−0.8 (6)
C10—C1—C2—C3−4.4 (4)C19—C20—C21—C220.9 (5)
O1—C1—C10—C9−179.4 (2)C20—C21—C22—C17−0.6 (5)
O1—C1—C10—C1112.0 (4)C20—C21—C22—C23177.3 (3)
C2—C1—C10—C93.1 (4)C17—C22—C23—C243.9 (5)
C2—C1—C10—C11−165.4 (2)C21—C22—C23—C24−174.0 (3)
C1—C2—C3—C42.2 (5)C22—C23—C24—C25−0.8 (5)
C2—C3—C4—C5−177.8 (3)C23—C24—C25—O2177.1 (3)
C2—C3—C4—C91.2 (5)C23—C24—C25—C16−5.1 (5)
C3—C4—C5—C6179.3 (3)
D—H···AD—HH···AD···AD—H···A
C6—H6···O3i0.952.433.328 (5)159
C11—H11···O4ii0.952.383.297 (3)161
C12—H12A···O40.992.472.974 (4)111
C27—H27A···O3ii0.982.553.490 (4)161
C28—H28A···O2iii0.992.403.213 (5)139
C28—H28A···O4iii0.992.533.429 (6)151
Table 1

Selected bond lengths (Å)

Mo1—O12.0888 (19)
Mo1—O21.957 (2)
Mo1—O31.702 (2)
Mo1—O41.713 (2)
Mo1—N12.118 (2)
Mo1—N22.297 (2)
Table 2

Hydrogen-bond geometry (Å, °)

D—H⋯AD—HH⋯ADAD—H⋯A
C6—H6⋯O3i0.952.433.328 (5)159
C11—H11⋯O4ii0.952.383.297 (3)161
C12—H12A⋯O40.992.472.974 (4)111
C27—H27A⋯O3ii0.982.553.490 (4)161
C28—H28A⋯O2iii0.992.403.213 (5)139
C28—H28A⋯O4iii0.992.533.429 (6)151

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

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Authors:  George M Sheldrick
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