Information card for entry 4346694

Structure parameters

• Common name: 13242
• Formula: C21 H24 Co Cu N7
• Calculated formula: C21 H24 Co Cu N7
• Title of publication: Influence of Copper Oxidation State on the Bonding and Electronic Structure of Cobalt-Copper Complexes.
• Authors of publication: Eisenhart, Reed J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Chen, Yu-Sheng; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 11330 - 11338
• a: 18.8953 ± 0.0017 Å
• b: 18.8953 ± 0.0017 Å
• c: 11.191 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3460.2 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.0931
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 0.41328 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No