Information card for entry 8103250

Structure parameters

• Formula: C18 H24 Co N10 O2 S4
• Calculated formula: C18 H24 Co N10 O2 S4
• Title of publication: Crystal structure of bis(biimidazole-?2N,N')-bis(isothiocyanato-?N)cobalt(II) — dimethylsulfoxide (1:2), Co(C6H6N4)2(NCS)2 • 2C2H6SO
• Authors of publication: Qi-Ming Qiu; Yu-Heng Deng; Jing-Jing Sun; Wei Yang; Qiong-Hua Jin; Cun-Lin Zhang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 625
• a: 8.0209 ± 0.0011 Å
• b: 16.12 ± 0.002 Å
• c: 10.4796 ± 0.0015 Å
• α: 90°
• β: 90.903 ± 0.001°
• γ: 90°
• Cell volume: 1354.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0825
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.2002
• Weighted residual factors for all reflections included in the refinement: 0.2161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.196
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No