Information card for entry 4327587

Structure parameters

• Formula: C129 H106 Cl6 Co2 N12 O
• Calculated formula: C129 H98 Cl6 Co2 N12 O
• Title of publication: Alkyl and Aryl Substituted Corroles. 1. Synthesis and Characterization of Free Base and Cobalt Containing Derivatives. X-ray Structure of (Me4Ph5Cor)Co(py)2
• Authors of publication: Roger Guilard; Claude P. Gros; Frédéric Bolze; François Jérôme; Zhongping Ou; Jianguo Shao; Jean Fischer; Raymond Weiss; Karl M. Kadish
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 4845 - 4855
• a: 19.569 ± 0.0004 Å
• b: 17.107 ± 0.0006 Å
• c: 15.916 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5328.1 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.111
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for all reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections: 1.92
• Goodness-of-fit parameter for all reflections included in the refinement: 1.488
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No