Information card for entry 1512893

Structure parameters

• Formula: C20 H24.5 Cu4 Mo5 N15 O23.75 P2
• Calculated formula: C20 H19 Cu3.5 Mo5 N15 O23.5 P2
• Title of publication: Three-dimensional bimetallic oxides constructed from molybdophosphonate chains and secondary-metal/4-pyridyltetrazole components
• Authors of publication: Stephanie Jones; Kari Darling; Jon Zubieta
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 395
• Pages of publication: 89 - 94
• a: 25.662 ± 0.003 Å
• b: 15.9357 ± 0.0018 Å
• c: 22.211 ± 0.003 Å
• α: 90°
• β: 114.353 ± 0.002°
• γ: 90°
• Cell volume: 8274.8 ± 1.8 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No