Information card for entry 7010081

Structure parameters

• Formula: C78 H121 Co2 O11.5 P2
• Calculated formula: C78 H118 Co2 O11.5 P2
• Title of publication: Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands
• Authors of publication: Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 24
• Pages of publication: 4656
• a: 15.036 ± 0.002 Å
• b: 16.294 ± 0.003 Å
• c: 18.969 ± 0.003 Å
• α: 99.19 ± 0.02°
• β: 102.99 ± 0.02°
• γ: 108.59 ± 0.02°
• Cell volume: 4155.3 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1266
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections: 0.1984
• Weighted residual factors for significantly intense reflections: 0.1642
• Goodness-of-fit parameter for all reflections: 1.015
• Goodness-of-fit parameter for significantly intense reflections: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No