Information card for entry 7009479

Structure parameters

• Formula: C8 H106 Ca5 Mo18 N4 O106
• Calculated formula: C8 H8 Ca5 Mo18 N4 O106
• Title of publication: Synthesis and crystal structure of novel ring-like polyoxomolybdate and its 2-D self-assembly
• Authors of publication: Liu, Guang; Wei, Yong-Ge; Liu, Jian; Liu, Qun; Zhang, Shi-Wei; Tang, You-Qi
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 7
• Pages of publication: 1013
• a: 11.453 ± 0.002 Å
• b: 14.51 ± 0.003 Å
• c: 17.654 ± 0.004 Å
• α: 114.07 ± 0.03°
• β: 93.8 ± 0.03°
• γ: 90.24 ± 0.03°
• Cell volume: 2671.2 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0677
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1569
• Weighted residual factors for all reflections included in the refinement: 0.1663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No