Information card for entry 4332498

Structure parameters

• Formula: C4 H4 N2 Ni O10 V4
• Calculated formula: C4 H4 N2 Ni O10 V4
• Title of publication: Spin-Gap Formation and Thermal Structural Studies in Reduced Hybrid Layered Vanadates
• Authors of publication: Yan, Bangbo; Luo, Junhua; Dube, Paul; Sefat, Athena S.; Greedan, John E.; Maggard, Paul A.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 13
• Pages of publication: 5109 - 5118
• a: 14.2372 ± 0.0004 Å
• b: 6.9008 ± 0.0002 Å
• c: 11.5102 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1130.85 ± 0.05 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0245
• Residual factor for significantly intense reflections: 0.0206
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0611
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No