Information card for entry 4508310

Structure parameters

• Formula: C7 H18 N2 O14 Se2 V2
• Calculated formula: C7 H18 N2 O14 Se2 V2
• Title of publication: Formation Principles for Templated Vanadium Selenite Oxalates
• Authors of publication: Koffer, Jacob H.; Olshansky, Jacob H.; Smith, Matthew D.; Hernandez, Kristen J.; Zeller, Matthias; Ferrence, Gregory M.; Schrier, Joshua; Norquist, Alexander J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 10
• Pages of publication: 4504
• a: 9.227 ± 0.005 Å
• b: 11.244 ± 0.005 Å
• c: 9.362 ± 0.005 Å
• α: 90°
• β: 116.077 ± 0.005°
• γ: 90°
• Cell volume: 872.4 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for all reflections: 0.0866
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0733
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8758
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No