Information card for entry 7110708

Structure parameters

• Formula: C25 H56 Co N8 O7
• Calculated formula: C25 H54 Co N8 O7
• SMILES: CC12C[NH]3CC(C[NH]4CC5(C)C[NH]6[Co]734([NH](C1)CC(C)(C[NH]7C5)C)[NH](CC(C6)(C)C)C2)(C)C.N(=O)(=O)[O-].O.N(=O)(=O)[O-]
• Title of publication: Sterically induced transmutations in cobalt amine chemistry
• Authors of publication: Geue, Rodney J.; Jin Qin, C.; Ralph, Stephen F.; Sargeson, Alan M.; Skelton, Brian W.; White, Allan H.; Willis, Anthony C.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 23
• Pages of publication: 2351 - 2352
• a: 10.442 ± 0.003 Å
• b: 17.347 ± 0.006 Å
• c: 17.83 ± 0.005 Å
• α: 90°
• β: 105.31 ± 0.02°
• γ: 90°
• Cell volume: 3115.1 ± 1.7 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.032
• Goodness-of-fit parameter for all reflections included in the refinement: 2.01
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No