Information card for entry 4319502

Structure parameters

• Formula: C36 H30 N O5 P2 Se V
• Calculated formula: C36 H30 N O5 P2 Se V
• Title of publication: Synthesis and Structural Characterization of a New Series of Vanadoselenites, [SexV4-xO12-x](4-x)- (x = 1, 2)
• Authors of publication: H. Nakano; T. Ozeki; A. Yagasaki
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1816 - 1819
• a: 12.2931 ± 0.0003 Å
• b: 13.5101 ± 0.0003 Å
• c: 20.9793 ± 0.0005 Å
• α: 90°
• β: 106.307 ± 0.001°
• γ: 90°
• Cell volume: 3344.09 ± 0.14 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0799
• Weighted residual factors for all reflections included in the refinement: 0.0903
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No