Information card for entry 4330711

Structure parameters

• Formula: C5 H20 N2 O16 Se4 V2
• Calculated formula: C5 H20 N2 O16 Se4 V2
• Title of publication: Role of Hydrogen-Bonding in the Formation of Polar Achiral and Nonpolar Chiral Vanadium Selenite Frameworks
• Authors of publication: Jacob H. Olshansky; Thanh Thao Tran; Kristen J. Hernandez; Matthias Zeller; P. Shiv Halasyamani; Joshua Schrier; Alexander J. Norquist
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 11040 - 11048
• a: 14.419 ± 0.002 Å
• b: 12.682 ± 0.002 Å
• c: 10.5365 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1926.7 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0267
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for all reflections: 0.0665
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No