Information card for entry 7234764

Structure parameters

• Formula: C30 H83 N6 O75 P2 Re2 W17
• Calculated formula: C30 N6 O75 P2 Re2 W17
• Title of publication: A new phoshotungstate-supported rhenium carbonyl derivative: synthesis, characterization and catalytic selective oxidation of thiophenes
• Authors of publication: Niu, Jingyang; Lu, Jingkun; Feng, Junwei; Ma, Xinyi; Wang, Ping; Xu, Baijie; He, Peipei; Jia, Jiage; Ma, Pengtao; Wang, Jingping
• Journal of publication: CrystEngComm
• Year of publication: 2019
• a: 28.1534 ± 0.0016 Å
• b: 13.4987 ± 0.0008 Å
• c: 31.1648 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11843.7 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1273
• Weighted residual factors for all reflections included in the refinement: 0.1463
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No