Information card for entry 2005625

Structure parameters

• Formula: C19 H32 Co N7 S3
• Calculated formula: C19 H32 Co N7 S3
• Title of publication: <i>trans</i>-(5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')di(isothiocyanato-<i>N</i>)cobalt(III) Thiocyanate
• Authors of publication: Lu, T.-H.; Tahirov, T. H.; Chen, B.-H.; Lai, C.-Y.; Chung, C.-S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 11
• Pages of publication: 2684 - 2687
• a: 12.169 ± 0.002 Å
• b: 13.576 ± 0.001 Å
• c: 14.919 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2464.7 ± 0.5 ų
• Cell temperature: 298 ± 3 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.055
• Goodness-of-fit parameter for significantly intense reflections: 1.52
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No