Information card for entry 4305713

Structure parameters

• Common name: Chisholm 1332
• Formula: C48 H66 Mo2 N2 O10 S2
• Calculated formula: C48 H66 Mo2 N2 O10 S2
• Title of publication: Dimolybdenum Bis-2,4,6-triisopropyl-benzoate Bis-4-isonicotinate: A Redox Active Analogue of 4,4'-Bipyridine with Ambivalent Properties
• Authors of publication: Malcolm H. Chisholm; Angela S. Dann; Fabian Dielmann; Judith C. Gallucci; Nathan J. Patmore; Ramkrishna Ramnauth; Manfred Scheer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 9248 - 9255
• a: 10.2059 ± 0.001 Å
• b: 10.248 ± 0.002 Å
• c: 13.932 ± 0.002 Å
• α: 86.24 ± 0.008°
• β: 84.046 ± 0.009°
• γ: 62.388 ± 0.006°
• Cell volume: 1284 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0601
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1143
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No