Information card for entry 7232150

Structure parameters

• Formula: C30 H48 Mo5 N12 O29 S
• Calculated formula: C30 H42 Mo5 N12 O29 S
• Title of publication: Molybdenum imidazole citrate and bipyridine homocitrate in different oxidation states ‒ balance between coordinated α-hydroxy and α-alkoxy groups
• Authors of publication: Wang, Si-Yuan; Zhou, Zhao-Hui
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 1
• Pages of publication: 519
• a: 21.9484 ± 0.0004 Å
• b: 15.2878 ± 0.0003 Å
• c: 15.523 ± 0.0003 Å
• α: 90°
• β: 103.66 ± 0.002°
• γ: 90°
• Cell volume: 5061.3 ± 0.17 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No