Literature DB >> 23476351

Tris(2,2'-bipyridine-κ(2) N,N')cobalt(II) bis-(hexa-fluoridophosphate).

Ayfer Menteş1, Kuldip Singh.   

Abstract

In the title compound, [Co(C10H8N2)3](PF6)2, the Co(II) atom is coordinated by the six N atoms of three 2,2'-bipyridyl ligands and adopts a highly distorted octa-hedral geometry. The crystal used was a merohedral twin, the refined ratio of twin components being 0.820 (1):0.180 (1). The crystal structure features weak C-H⋯F inter-actions, forming a three-dimensional network.

Entities:  

Year:  2012        PMID： 23476351      PMCID： PMC3588389          DOI： 10.1107/S1600536812050234

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


Related literature

For related structures, see: Chygorin et al. (2012 ▶); Liu et al. (2008 ▶, 2010 ▶).

Experimental

Crystal data

[Co(C10H8N2)3](PF6)2 M = 817.42 Trigonal, a = 10.3524 (18) Å c = 26.140 (6) Å V = 2426.2 (8) Å3 Z = 3 Mo Kα radiation μ = 0.73 mm−1 T = 150 K 0.35 × 0.16 × 0.13 mm

Data collection

Bruker APEX 2000 CCD area-detector diffractometer Absorption correction: multi-scan (SADABS; Bruker, 2005 ▶) T min = 0.581, T max = 0.862 19252 measured reflections 6285 independent reflections 5344 reflections with I > 2σ(I) R int = 0.087

Refinement

R[F 2 > 2σ(F 2)] = 0.049 wR(F 2) = 0.088 S = 0.94 6285 reflections 461 parameters 1 restraint H-atom parameters constrained Δρmax = 0.30 e Å−3 Δρmin = −0.31 e Å−3 Absolute structure: Flack (1983 ▶), 3114 Friedel pairs Flack parameter: 0.010 (18) Data collection: APEX2 (Bruker, 2005 ▶); cell refinement: SAINT (Bruker, 2005 ▶); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: SHELXTL (Sheldrick, 2008 ▶); software used to prepare material for publication: SHELXTL. Click here for additional data file. Crystal structure: contains datablock(s) I, global. DOI: 10.1107/S1600536812050234/lr2090sup1.cif Click here for additional data file. Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536812050234/lr2090Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Co(C10H8N2)3](PF6)2Dx = 1.678 Mg m−3
Mr = 817.42Melting point: 594 K
Trigonal, P32Mo Kα radiation, λ = 0.71073 Å
Hall symbol: P 32Cell parameters from 812 reflections
a = 10.3524 (18) Åθ = 2.3–28.2°
c = 26.140 (6) ŵ = 0.73 mm−1
V = 2426.2 (8) Å3T = 150 K
Z = 3Needle, yellow
F(000) = 12330.35 × 0.16 × 0.13 mm
Bruker APEX 2000 CCD area-detector diffractometer6285 independent reflections
Radiation source: fine-focus sealed tube5344 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.087
phi and ω scansθmax = 26.0°, θmin = 0.8°
Absorption correction: multi-scan (SADABS; Bruker, 2005)h = −12→12
Tmin = 0.581, Tmax = 0.862k = −12→12
19252 measured reflectionsl = −32→32
Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.049H-atom parameters constrained
wR(F2) = 0.088w = 1/[σ2(Fo2) + (0.0279P)2] where P = (Fo2 + 2Fc2)/3
S = 0.94(Δ/σ)max = 0.002
6285 reflectionsΔρmax = 0.30 e Å−3
461 parametersΔρmin = −0.31 e Å−3
1 restraintAbsolute structure: Flack (1983), 3114 Friedel pairs
Primary atom site location: structure-invariant direct methodsFlack parameter: 0.010 (18)
Experimental. SADABS (Bruker, 2005). Absorption correction based on 7715 reflections;Rint 0.1489 before correction and 0.0570 after.
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
Co10.31501 (7)0.63587 (6)0.16543 (3)0.02682 (14)
N10.5410 (4)0.7831 (4)0.18887 (15)0.0288 (9)
N20.4286 (4)0.5271 (4)0.13828 (15)0.0286 (9)
N30.2500 (4)0.5252 (4)0.23714 (14)0.0278 (9)
N40.2286 (4)0.7570 (4)0.20398 (14)0.0270 (9)
N50.1048 (4)0.4858 (4)0.13110 (14)0.0285 (9)
N60.3326 (4)0.7329 (4)0.09234 (14)0.0321 (9)
C10.5893 (5)0.9086 (5)0.21651 (19)0.0322 (11)
H10.52200.94400.22290.039*
C20.7309 (5)0.9875 (6)0.23577 (18)0.0339 (12)
H20.76171.07560.25520.041*
C30.8278 (6)0.9347 (6)0.22598 (19)0.0426 (13)
H30.92650.98530.23920.051*
C40.7788 (6)0.8074 (6)0.19675 (19)0.0394 (13)
H40.84430.77030.18950.047*
C50.6371 (5)0.7354 (5)0.17835 (17)0.0270 (10)
C60.5765 (5)0.5992 (5)0.14565 (17)0.0271 (10)
C70.6663 (6)0.5535 (6)0.12261 (19)0.0353 (11)
H70.77110.60790.12790.042*
C80.6041 (6)0.4286 (6)0.0919 (2)0.0411 (13)
H80.66530.39810.07470.049*
C90.4511 (6)0.3490 (6)0.0865 (2)0.0374 (13)
H90.40420.25930.06710.045*
C100.3682 (5)0.4021 (5)0.10954 (18)0.0348 (12)
H100.26300.34830.10510.042*
C110.2541 (6)0.4024 (5)0.24997 (19)0.0365 (13)
H110.31110.37310.22960.044*
C120.1780 (6)0.3163 (5)0.2920 (2)0.0383 (13)
H120.18450.23070.30070.046*
C130.0928 (6)0.3568 (6)0.3209 (2)0.0452 (14)
H130.03660.29740.34910.054*
C140.0903 (6)0.4854 (6)0.3082 (2)0.0425 (13)
H140.03320.51620.32780.051*
C150.1714 (5)0.5678 (5)0.26678 (17)0.0282 (10)
C160.1795 (5)0.7093 (5)0.25162 (18)0.0286 (11)
C170.1413 (6)0.7889 (6)0.2842 (2)0.0392 (13)
H170.10330.75190.31740.047*
C180.1594 (7)0.9260 (6)0.2675 (2)0.0486 (15)
H180.13960.98620.29000.058*
C190.2056 (6)0.9712 (6)0.2188 (2)0.0395 (13)
H190.21441.06130.20620.047*
C200.2391 (5)0.8847 (5)0.18840 (19)0.0312 (11)
H200.27160.91710.15440.037*
C21−0.0026 (5)0.3604 (6)0.1512 (2)0.0385 (12)
H210.00530.34070.18620.046*
C22−0.1253 (6)0.2570 (6)0.1241 (2)0.0435 (14)
H22−0.19990.16830.14000.052*
C23−0.1365 (6)0.2856 (6)0.0737 (2)0.0456 (14)
H23−0.21780.21510.05360.055*
C24−0.0301 (6)0.4160 (6)0.0526 (2)0.0405 (13)
H24−0.03910.43840.01800.049*
C250.0928 (5)0.5172 (6)0.08174 (19)0.0302 (11)
C260.2129 (5)0.6598 (5)0.06185 (18)0.0305 (11)
C270.2036 (6)0.7188 (6)0.01585 (19)0.0425 (14)
H270.11680.6670−0.00470.051*
C280.3202 (7)0.8532 (6)−0.0003 (2)0.0453 (14)
H280.31440.8953−0.03200.054*
C290.4451 (6)0.9257 (6)0.0299 (2)0.0438 (14)
H290.52861.01730.01930.053*
C300.4453 (6)0.8611 (6)0.07615 (19)0.0391 (13)
H300.53070.91130.09740.047*
P10.6353 (2)0.34156 (18)0.26409 (5)0.0455 (4)
F10.7904 (4)0.4131 (6)0.23794 (18)0.1132 (18)
F20.6499 (10)0.2092 (8)0.2842 (2)0.210 (4)
F30.7010 (5)0.4240 (6)0.31495 (16)0.1132 (18)
F40.4748 (5)0.2696 (4)0.29142 (15)0.0856 (13)
F50.6100 (5)0.4687 (5)0.24542 (17)0.0983 (15)
F60.5659 (6)0.2568 (6)0.21402 (18)0.147 (2)
P20.03045 (17)0.98203 (18)0.07188 (5)0.0404 (4)
F70.1988 (3)1.0180 (4)0.06828 (15)0.0606 (10)
F8−0.0149 (4)0.8242 (4)0.09591 (15)0.0720 (12)
F90.0629 (4)1.0539 (3)0.12771 (11)0.0566 (9)
F10−0.1379 (3)0.9457 (4)0.07615 (14)0.0608 (10)
F110.0790 (4)1.1424 (3)0.04879 (12)0.0582 (9)
F12−0.0020 (4)0.9120 (4)0.01613 (13)0.0643 (10)
U11U22U33U12U13U23
Co10.0283 (4)0.0289 (3)0.0231 (3)0.0142 (3)−0.0001 (3)0.0007 (3)
N10.030 (2)0.028 (2)0.026 (2)0.0130 (19)−0.0016 (17)0.0015 (17)
N20.031 (2)0.029 (2)0.026 (2)0.0143 (19)0.0033 (18)0.0013 (18)
N30.032 (2)0.029 (2)0.024 (2)0.0158 (19)−0.0067 (18)−0.0026 (17)
N40.027 (2)0.029 (2)0.027 (2)0.0162 (18)0.0002 (17)0.0004 (18)
N50.027 (2)0.033 (2)0.026 (2)0.0156 (19)−0.0062 (17)−0.0019 (18)
N60.033 (2)0.034 (2)0.029 (2)0.017 (2)−0.0004 (18)0.0030 (18)
C10.037 (3)0.033 (3)0.031 (3)0.020 (2)0.003 (2)0.002 (2)
C20.036 (3)0.031 (3)0.027 (3)0.010 (2)0.003 (2)−0.003 (2)
C30.032 (3)0.054 (4)0.036 (3)0.017 (3)−0.004 (2)−0.008 (3)
C40.032 (3)0.049 (3)0.040 (3)0.023 (3)0.003 (2)−0.007 (3)
C50.035 (3)0.026 (2)0.021 (2)0.016 (2)−0.001 (2)0.001 (2)
C60.031 (3)0.026 (3)0.022 (3)0.012 (2)0.000 (2)0.001 (2)
C70.036 (3)0.035 (3)0.037 (3)0.020 (3)0.000 (2)−0.003 (2)
C80.039 (3)0.041 (3)0.047 (3)0.023 (3)0.010 (3)−0.003 (3)
C90.043 (3)0.031 (3)0.038 (3)0.018 (3)0.001 (2)−0.005 (2)
C100.027 (3)0.030 (3)0.040 (3)0.008 (2)−0.002 (2)−0.003 (2)
C110.041 (3)0.031 (3)0.040 (3)0.020 (2)0.000 (2)−0.003 (2)
C120.047 (3)0.026 (3)0.041 (3)0.018 (3)−0.002 (3)0.006 (2)
C130.061 (4)0.042 (3)0.032 (3)0.026 (3)0.007 (3)0.010 (3)
C140.054 (3)0.050 (3)0.032 (3)0.032 (3)0.012 (3)0.008 (3)
C150.032 (2)0.031 (3)0.022 (2)0.016 (2)−0.003 (2)−0.001 (2)
C160.022 (2)0.030 (3)0.030 (3)0.010 (2)0.002 (2)0.003 (2)
C170.059 (4)0.046 (3)0.025 (3)0.036 (3)0.007 (3)0.010 (3)
C180.072 (4)0.053 (4)0.044 (4)0.049 (3)−0.001 (3)−0.004 (3)
C190.052 (3)0.037 (3)0.040 (3)0.030 (3)−0.005 (3)−0.001 (3)
C200.030 (3)0.032 (3)0.030 (3)0.014 (2)0.001 (2)0.006 (2)
C210.028 (3)0.044 (3)0.037 (3)0.014 (3)0.002 (2)0.002 (2)
C220.034 (3)0.041 (3)0.044 (3)0.009 (3)−0.004 (2)0.004 (3)
C230.030 (3)0.050 (4)0.045 (4)0.011 (3)−0.008 (3)−0.004 (3)
C240.044 (3)0.052 (4)0.028 (3)0.026 (3)−0.009 (2)−0.003 (3)
C250.027 (3)0.036 (3)0.030 (3)0.018 (2)0.002 (2)0.003 (2)
C260.033 (3)0.038 (3)0.028 (3)0.023 (2)0.000 (2)−0.004 (2)
C270.052 (4)0.053 (4)0.025 (3)0.028 (3)−0.001 (3)0.005 (3)
C280.056 (4)0.055 (4)0.028 (3)0.030 (3)0.006 (3)0.010 (3)
C290.054 (4)0.045 (3)0.032 (3)0.025 (3)0.012 (3)0.008 (2)
C300.045 (3)0.042 (3)0.024 (3)0.017 (3)0.002 (2)0.002 (2)
P10.0655 (11)0.0525 (10)0.0310 (9)0.0388 (9)0.0047 (7)0.0015 (7)
F10.064 (3)0.187 (5)0.088 (3)0.062 (3)0.025 (2)−0.003 (3)
F20.424 (12)0.227 (7)0.152 (5)0.293 (9)0.170 (7)0.125 (5)
F30.094 (3)0.200 (5)0.047 (2)0.075 (4)−0.028 (2)−0.044 (3)
F40.089 (3)0.077 (3)0.074 (3)0.029 (2)0.034 (2)0.009 (2)
F50.126 (4)0.107 (4)0.101 (3)0.087 (3)0.032 (3)0.055 (3)
F60.148 (5)0.124 (4)0.074 (3)−0.004 (4)0.016 (3)−0.057 (3)
P20.0351 (8)0.0404 (8)0.0340 (8)0.0101 (6)−0.0021 (6)−0.0015 (7)
F70.0390 (19)0.050 (2)0.081 (3)0.0129 (16)−0.0036 (18)−0.0054 (18)
F80.073 (3)0.0357 (19)0.087 (3)0.0123 (18)0.017 (2)0.0097 (18)
F90.067 (2)0.056 (2)0.0326 (17)0.0197 (18)−0.0080 (15)−0.0012 (14)
F100.0332 (17)0.068 (2)0.066 (2)0.0142 (17)−0.0034 (16)−0.0194 (19)
F110.072 (2)0.0511 (19)0.0422 (19)0.0244 (19)−0.0013 (18)0.0096 (16)
F120.060 (2)0.072 (2)0.048 (2)0.0230 (19)−0.0049 (17)−0.0207 (19)
Co1—N22.117 (4)C14—C151.374 (7)
Co1—N32.123 (4)C14—H140.9500
Co1—N62.124 (4)C15—C161.479 (6)
Co1—N42.124 (4)C16—C171.374 (7)
Co1—N52.139 (4)C17—C181.405 (7)
Co1—N12.146 (4)C17—H170.9500
N1—C51.342 (6)C18—C191.357 (7)
N1—C11.345 (6)C18—H180.9500
N2—C61.340 (6)C19—C201.366 (7)
N2—C101.349 (6)C19—H190.9500
N3—C111.336 (6)C20—H200.9500
N3—C151.347 (6)C21—C221.379 (7)
N4—C201.335 (6)C21—H210.9500
N4—C161.342 (6)C22—C231.367 (7)
N5—C211.324 (6)C22—H220.9500
N5—C251.352 (6)C23—C241.362 (7)
N6—C301.324 (6)C23—H230.9500
N6—C261.344 (6)C24—C251.402 (7)
C1—C21.368 (6)C24—H240.9500
C1—H10.9500C25—C261.469 (7)
C2—C31.385 (7)C26—C271.374 (6)
C2—H20.9500C27—C281.375 (7)
C3—C41.382 (7)C27—H270.9500
C3—H30.9500C28—C291.374 (8)
C4—C51.359 (6)C28—H280.9500
C4—H40.9500C29—C301.383 (7)
C5—C61.493 (6)C29—H290.9500
C6—C71.374 (6)C30—H300.9500
C7—C81.378 (7)P1—F61.539 (5)
C7—H70.9500P1—F31.542 (4)
C8—C91.380 (7)P1—F21.544 (5)
C8—H80.9500P1—F51.545 (4)
C9—C101.368 (7)P1—F11.551 (4)
C9—H90.9500P1—F41.609 (4)
C10—H100.9500P2—F121.587 (4)
C11—C121.386 (7)P2—F81.587 (4)
C11—H110.9500P2—F101.592 (3)
C12—C131.376 (7)P2—F71.592 (4)
C12—H120.9500P2—F111.594 (4)
C13—C141.385 (7)P2—F91.596 (3)
C13—H130.9500
N2—Co1—N396.86 (15)C14—C15—C16122.7 (4)
N2—Co1—N690.63 (15)N4—C16—C17121.6 (4)
N3—Co1—N6168.13 (15)N4—C16—C15115.9 (4)
N2—Co1—N4169.58 (15)C17—C16—C15122.5 (4)
N3—Co1—N477.66 (14)C16—C17—C18118.7 (5)
N6—Co1—N496.28 (15)C16—C17—H17120.6
N2—Co1—N596.15 (15)C18—C17—H17120.6
N3—Co1—N592.62 (14)C19—C18—C17119.0 (5)
N6—Co1—N577.38 (15)C19—C18—H18120.5
N4—Co1—N592.97 (14)C17—C18—H18120.5
N2—Co1—N177.02 (15)C18—C19—C20118.8 (5)
N3—Co1—N194.01 (14)C18—C19—H19120.6
N6—Co1—N196.65 (15)C20—C19—H19120.6
N4—Co1—N194.39 (15)N4—C20—C19123.3 (5)
N5—Co1—N1171.00 (15)N4—C20—H20118.3
C5—N1—C1118.6 (4)C19—C20—H20118.3
C5—N1—Co1115.2 (3)N5—C21—C22123.6 (5)
C1—N1—Co1125.9 (3)N5—C21—H21118.2
C6—N2—C10117.8 (4)C22—C21—H21118.2
C6—N2—Co1116.1 (3)C23—C22—C21118.1 (5)
C10—N2—Co1125.6 (3)C23—C22—H22120.9
C11—N3—C15118.6 (4)C21—C22—H22120.9
C11—N3—Co1125.6 (3)C24—C23—C22119.5 (5)
C15—N3—Co1114.3 (3)C24—C23—H23120.3
C20—N4—C16118.4 (4)C22—C23—H23120.3
C20—N4—Co1126.2 (3)C23—C24—C25120.1 (5)
C16—N4—Co1114.6 (3)C23—C24—H24119.9
C21—N5—C25118.8 (4)C25—C24—H24119.9
C21—N5—Co1126.6 (3)N5—C25—C24119.8 (4)
C25—N5—Co1114.1 (3)N5—C25—C26116.5 (4)
C30—N6—C26118.5 (4)C24—C25—C26123.7 (5)
C30—N6—Co1125.9 (3)N6—C26—C27121.2 (5)
C26—N6—Co1115.5 (3)N6—C26—C25115.8 (4)
N1—C1—C2123.0 (5)C27—C26—C25123.0 (5)
N1—C1—H1118.5C26—C27—C28119.9 (5)
C2—C1—H1118.5C26—C27—H27120.1
C1—C2—C3117.9 (5)C28—C27—H27120.1
C1—C2—H2121.1C29—C28—C27119.1 (5)
C3—C2—H2121.1C29—C28—H28120.5
C4—C3—C2119.1 (5)C27—C28—H28120.5
C4—C3—H3120.5C28—C29—C30117.8 (5)
C2—C3—H3120.5C28—C29—H29121.1
C5—C4—C3120.0 (5)C30—C29—H29121.1
C5—C4—H4120.0N6—C30—C29123.4 (5)
C3—C4—H4120.0N6—C30—H30118.3
N1—C5—C4121.4 (4)C29—C30—H30118.3
N1—C5—C6115.3 (4)F6—P1—F3178.5 (3)
C4—C5—C6123.3 (4)F6—P1—F290.5 (4)
N2—C6—C7121.7 (4)F3—P1—F289.2 (4)
N2—C6—C5115.6 (4)F6—P1—F589.3 (3)
C7—C6—C5122.6 (4)F3—P1—F590.9 (3)
C6—C7—C8119.9 (5)F2—P1—F5176.2 (4)
C6—C7—H7120.0F6—P1—F188.5 (3)
C8—C7—H7120.0F3—P1—F192.9 (3)
C7—C8—C9118.6 (5)F2—P1—F192.1 (4)
C7—C8—H8120.7F5—P1—F191.7 (3)
C9—C8—H8120.7F6—P1—F491.9 (3)
C10—C9—C8118.6 (5)F3—P1—F486.6 (2)
C10—C9—H9120.7F2—P1—F488.6 (3)
C8—C9—H9120.7F5—P1—F487.6 (2)
N2—C10—C9123.2 (5)F1—P1—F4179.2 (3)
N2—C10—H10118.4F12—P2—F890.4 (2)
C9—C10—H10118.4F12—P2—F1090.0 (2)
N3—C11—C12122.2 (5)F8—P2—F1090.2 (2)
N3—C11—H11118.9F12—P2—F790.5 (2)
C12—C11—H11118.9F8—P2—F789.4 (2)
C13—C12—C11119.0 (5)F10—P2—F7179.4 (2)
C13—C12—H12120.5F12—P2—F1190.7 (2)
C11—C12—H12120.5F8—P2—F11178.6 (2)
C12—C13—C14118.9 (5)F10—P2—F1190.6 (2)
C12—C13—H13120.5F7—P2—F1189.8 (2)
C14—C13—H13120.5F12—P2—F9179.4 (2)
C15—C14—C13119.1 (5)F8—P2—F990.2 (2)
C15—C14—H14120.5F10—P2—F989.79 (19)
C13—C14—H14120.5F7—P2—F989.68 (19)
N3—C15—C14122.1 (4)F11—P2—F988.70 (19)
N3—C15—C16115.2 (4)
N2—Co1—N1—C5−3.2 (3)C10—N2—C6—C73.6 (7)
N3—Co1—N1—C592.9 (3)Co1—N2—C6—C7−169.0 (4)
N6—Co1—N1—C5−92.3 (3)C10—N2—C6—C5−179.1 (4)
N4—Co1—N1—C5170.8 (3)Co1—N2—C6—C58.2 (5)
N2—Co1—N1—C1−176.9 (4)N1—C5—C6—N2−11.1 (6)
N3—Co1—N1—C1−80.8 (4)C4—C5—C6—N2168.7 (5)
N6—Co1—N1—C194.0 (4)N1—C5—C6—C7166.1 (4)
N4—Co1—N1—C1−2.9 (4)C4—C5—C6—C7−14.1 (7)
N3—Co1—N2—C6−95.6 (3)N2—C6—C7—C8−1.4 (7)
N6—Co1—N2—C693.7 (3)C5—C6—C7—C8−178.4 (4)
N4—Co1—N2—C6−38.0 (10)C6—C7—C8—C9−2.3 (7)
N5—Co1—N2—C6171.0 (3)C7—C8—C9—C103.6 (8)
N1—Co1—N2—C6−3.0 (3)C6—N2—C10—C9−2.2 (7)
N3—Co1—N2—C1092.5 (4)Co1—N2—C10—C9169.6 (4)
N6—Co1—N2—C10−78.3 (4)C8—C9—C10—N2−1.4 (8)
N4—Co1—N2—C10150.0 (7)C15—N3—C11—C121.3 (7)
N5—Co1—N2—C10−0.9 (4)Co1—N3—C11—C12−164.1 (4)
N1—Co1—N2—C10−175.0 (4)N3—C11—C12—C131.4 (8)
N2—Co1—N3—C11−14.2 (4)C11—C12—C13—C14−2.4 (8)
N6—Co1—N3—C11114.6 (8)C12—C13—C14—C150.8 (8)
N4—Co1—N3—C11174.8 (4)C11—N3—C15—C14−3.0 (7)
N5—Co1—N3—C1182.4 (4)Co1—N3—C15—C14164.0 (4)
N1—Co1—N3—C11−91.5 (4)C11—N3—C15—C16176.7 (4)
N2—Co1—N3—C15179.9 (3)Co1—N3—C15—C16−16.3 (5)
N6—Co1—N3—C15−51.3 (9)C13—C14—C15—N32.0 (8)
N4—Co1—N3—C158.9 (3)C13—C14—C15—C16−177.7 (5)
N5—Co1—N3—C15−83.6 (3)C20—N4—C16—C17−0.3 (7)
N1—Co1—N3—C15102.5 (3)Co1—N4—C16—C17170.2 (4)
N2—Co1—N4—C20111.0 (8)C20—N4—C16—C15−179.5 (4)
N3—Co1—N4—C20170.1 (4)Co1—N4—C16—C15−9.1 (5)
N6—Co1—N4—C20−20.3 (4)N3—C15—C16—N417.1 (6)
N5—Co1—N4—C20−97.9 (4)C14—C15—C16—N4−163.2 (5)
N1—Co1—N4—C2076.9 (4)N3—C15—C16—C17−162.1 (4)
N2—Co1—N4—C16−58.6 (9)C14—C15—C16—C1717.6 (7)
N3—Co1—N4—C160.5 (3)N4—C16—C17—C18−2.3 (8)
N6—Co1—N4—C16170.2 (3)C15—C16—C17—C18176.9 (5)
N5—Co1—N4—C1692.5 (3)C16—C17—C18—C193.9 (9)
N1—Co1—N4—C16−92.7 (3)C17—C18—C19—C20−2.8 (9)
N2—Co1—N5—C2187.5 (4)C16—N4—C20—C191.4 (7)
N3—Co1—N5—C21−9.7 (4)Co1—N4—C20—C19−167.8 (4)
N6—Co1—N5—C21176.8 (4)C18—C19—C20—N40.2 (8)
N4—Co1—N5—C21−87.5 (4)C25—N5—C21—C221.9 (7)
N2—Co1—N5—C25−84.1 (3)Co1—N5—C21—C22−169.4 (4)
N3—Co1—N5—C25178.7 (3)N5—C21—C22—C230.0 (8)
N6—Co1—N5—C255.2 (3)C21—C22—C23—C24−2.1 (8)
N4—Co1—N5—C25100.9 (3)C22—C23—C24—C252.4 (8)
N2—Co1—N6—C30−88.2 (4)C21—N5—C25—C24−1.5 (7)
N3—Co1—N6—C30142.5 (7)Co1—N5—C25—C24170.8 (4)
N4—Co1—N6—C3084.0 (4)C21—N5—C25—C26178.3 (4)
N5—Co1—N6—C30175.7 (4)Co1—N5—C25—C26−9.4 (5)
N1—Co1—N6—C30−11.1 (4)C23—C24—C25—N5−0.6 (7)
N2—Co1—N6—C2696.2 (3)C23—C24—C25—C26179.6 (5)
N3—Co1—N6—C26−33.1 (9)C30—N6—C26—C27−2.9 (7)
N4—Co1—N6—C26−91.6 (3)Co1—N6—C26—C27173.1 (4)
N5—Co1—N6—C260.1 (3)C30—N6—C26—C25179.1 (4)
N1—Co1—N6—C26173.2 (3)Co1—N6—C26—C25−4.9 (5)
C5—N1—C1—C2−2.1 (7)N5—C25—C26—N69.7 (6)
Co1—N1—C1—C2171.4 (4)C24—C25—C26—N6−170.5 (5)
N1—C1—C2—C30.2 (7)N5—C25—C26—C27−168.3 (5)
C1—C2—C3—C41.1 (8)C24—C25—C26—C2711.5 (7)
C2—C3—C4—C5−0.4 (8)N6—C26—C27—C281.9 (8)
C1—N1—C5—C42.8 (7)C25—C26—C27—C28179.8 (5)
Co1—N1—C5—C4−171.4 (4)C26—C27—C28—C290.5 (8)
C1—N1—C5—C6−177.5 (4)C27—C28—C29—C30−1.8 (8)
Co1—N1—C5—C68.3 (5)C26—N6—C30—C291.5 (7)
C3—C4—C5—N1−1.5 (8)Co1—N6—C30—C29−174.0 (4)
C3—C4—C5—C6178.7 (4)C28—C29—C30—N60.8 (8)
D—H···AD—HH···AD···AD—H···A
C24—H24···F2i0.952.493.324 (7)146
C23—H23···F4i0.952.553.253 (7)131
C18—H18···F11ii0.952.523.149 (6)124
C13—H13···F10iii0.952.503.208 (6)131
C10—H10···F11iv0.952.513.265 (6)137
C9—H9···F7iv0.952.333.136 (6)142
C7—H7···F8v0.952.383.160 (7)139
C2—H2···F2vi0.952.333.081 (7)136
Table 1

Hydrogen-bond geometry (Å, °)

D—H⋯A D—HH⋯A D⋯A D—H⋯A
C24—H24⋯F2i 0.952.493.324 (7)146
C23—H23⋯F4i 0.952.553.253 (7)131
C18—H18⋯F11ii 0.952.523.149 (6)124
C13—H13⋯F10iii 0.952.503.208 (6)131
C10—H10⋯F11iv 0.952.513.265 (6)137
C9—H9⋯F7iv 0.952.333.136 (6)142
C7—H7⋯F8v 0.952.383.160 (7)139
C2—H2⋯F2vi 0.952.333.081 (7)136

Symmetry codes: (i) ; (ii) ; (iii) ; (iv) ; (v) ; (vi) .

  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.  Tris(2,2'-bipyridine)-cobalt(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexa-oxidohexa-molydate(VI).

Authors:  Ying Liu; Xianxi Zhang; Zechun Xue; Jian Sheng
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2010-06-05

3.  Tris(2,2'-bipyridine-κN:N')cobalt(III) trichloride tetra-hydrate.

Authors:  Wen Liu; Wei Xu; Jian-Li Lin; Hong-Zhen Xie
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2008-11-22

4.  Tris(2,2'-bipyridine-κN,N')cobalt(III) tris-(oxalato-κO,O)ferrate(III) mono-hydrate.

Authors:  Eduard N Chygorin; Svitlana R Petrusenko; Volodymyr N Kokozay; Irina V Omelchenko; Oleg V Shishkin
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2012-02-04
  4 in total

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