Information card for entry 1551643

Structure parameters

• Formula: C30 H40 Cl4 Co2 N10
• Calculated formula: C30 H40 Cl4 Co2 N10
• SMILES: [Co]1(Cl)(Cl)[n]2n(CN(c3ccc(N4Cn5[n]([Co](Cl)(Cl)[n]6n(C4)c(cc6C)C)c(cc5C)C)cc3)Cn3[n]1c(cc3C)C)c(cc2C)C
• Title of publication: Dinuclear Cobalt(II) Complex with <i>N</i>,<i>N</i>,<i>N</i>&prime;,<i>N</i>&prime;-Tetrakis(3,5-dimethyl-1-pyrazolyl)methyl-1,4-phenylenediamine Having a Tetrahedral Coordination Geometry
• Authors of publication: LIM, Jongwan; SON, Young; GU, Gimoon; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro
• Journal of publication: X-ray Structure Analysis Online
• Year of publication: 2015
• Journal volume: 31
• Journal issue: 0
• Pages of publication: 25
• a: 12.4671 ± 0.0016 Å
• b: 10.1719 ± 0.0013 Å
• c: 29.292 ± 0.004 Å
• α: 90°
• β: 101.26 ± 0.003°
• γ: 90°
• Cell volume: 3643.1 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1217
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1203
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No