Information card for entry 4344716

Structure parameters

• Formula: C47.63 H34.63 Cl0.74 N4.63 O4 V
• Calculated formula: C47.63 H34.63 Cl0.74 N4.63 O4 V
• Title of publication: Chemistry of Monomeric and Dinuclear Non-Oxido Vanadium(IV) and Oxidovanadium(V) Aroylazine Complexes: Exploring Solution Behavior.
• Authors of publication: Dash, Subhashree P.; Majumder, Sudarshana; Banerjee, Atanu; Carvalho, M Fernanda N N; Adão, Pedro; Pessoa, João Costa; Brzezinski, Krzysztof; Garribba, Eugenio; Reuter, Hans; Dinda, Rupam
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 1165 - 1182
• a: 11.8182 ± 0.0001 Å
• b: 19.0878 ± 0.0002 Å
• c: 16.5463 ± 0.0002 Å
• α: 90°
• β: 97.829 ± 0.001°
• γ: 90°
• Cell volume: 3697.78 ± 0.07 ų
• Cell temperature: 406 ± 2 K
• Ambient diffraction temperature: 406 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0863
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No