Information card for entry 4319376

Structure parameters

• Formula: C96.5 H99 Cl3 Mo4 N12 O16
• Calculated formula: C96.5 H96 Cl3 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: 10.6542 ± 0.0004 Å
• b: 13.442 ± 0.003 Å
• c: 35.848 ± 0.009 Å
• α: 94.062 ± 0.004°
• β: 91.781 ± 0.01°
• γ: 106.901 ± 0.011°
• Cell volume: 4892.7 ± 1.7 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 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: 0.0491
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections: 0.1322
• Weighted residual factors for significantly intense reflections: 0.1229
• Goodness-of-fit parameter for all reflections: 1.08
• Goodness-of-fit parameter for significantly intense reflections: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No