Information card for entry 4320196

Structure parameters

• Common name: 98047
• Formula: C21 H43 Co K N7 O4
• Calculated formula: C21 H43 Co K N7 O4
• Title of publication: Hydrogen-Bonding Cavities about Metal Ions: Synthesis, Structure, and Physical Properties for a Series of Monomeric M-OH Complexes Derived from Water
• Authors of publication: Cora E. MacBeth; Brian S. Hammes; Victor G. Young,; A. S. Borovik
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 4733 - 4741
• a: 10.7774 ± 0.0003 Å
• b: 11.3017 ± 0.0003 Å
• c: 11.725 ± 0.0002 Å
• α: 94.319 ± 0.001°
• β: 95.146 ± 0.001°
• γ: 98.003 ± 0.001°
• Cell volume: 1402.94 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections: 0.1144
• Weighted residual factors for significantly intense reflections: 0.1055
• Goodness-of-fit parameter for all reflections: 0.989
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No