Information card for entry 4319377

Structure parameters

• Formula: C103.5 H111 Cl7 F4 Mo4 N12 O16
• Calculated formula: C101.5 H97 Cl7 F4 Mo4 N12 O16
• Title of publication: The Simplest Supramolecular Complexes Containing Pairs of Mo2(formamidinate)3 Units Linked with Various Dicarboxylates: Preparative Methods, Structures, and Electrochemistry
• Authors of publication: F. Albert Cotton; James P. Donahue; Chun Lin; Carlos A. Murillo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1234 - 1244
• a: 17.431 ± 0.002 Å
• b: 19.63 ± 0.01 Å
• c: 31.801 ± 0.006 Å
• α: 90°
• β: 104.83 ± 0.02°
• γ: 90°
• Cell volume: 10519 ± 6 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections: 0.132
• Weighted residual factors for significantly intense reflections: 0.1268
• Goodness-of-fit parameter for all reflections: 1.102
• Goodness-of-fit parameter for significantly intense reflections: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No