Information card for entry 7210735

Structure parameters

• Formula: C168 H128 Mn6 N28 O135 P4 W36
• Calculated formula: C168 H130 Mn6 N28 O135 P4 W36
• Title of publication: Assembly of organic‒inorganic hybrid supramolecular materials based on {P2W18O62}6− anion and Cu(ii)/Mn(ii) complex
• Authors of publication: Yu, Kai; Yu, Yang; Jiang, Bo-Dong; Zhou, Bai-Bin
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 25
• Pages of publication: 5156
• a: 29.7818 ± 0.0017 Å
• b: 23.1391 ± 0.0013 Å
• c: 17.8019 ± 0.001 Å
• α: 90°
• β: 101.189 ± 0.001°
• γ: 90°
• Cell volume: 12034.5 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0394
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No