Information card for entry 7055484

Structure parameters

• Formula: C12 H20 N4 O10 V
• Calculated formula: C12 H20 N4 O10 V
• SMILES: [V]12([n]3c(C(=O)O1)ccc(c3)N)([n]1c(C(=O)O2)ccc(c1)N)(=O)[OH2].O.O.O.O
• Title of publication: Novel anti-diabetic and luminescent coordination compounds based on vanadium
• Authors of publication: Fernández, Belén; Gómez-Vílchez, Alejandro; Sánchez-González, Cristina; Bayón, Jakelhyne; San Sebastián, Eider; Gómez-Ruiz, Santiago; López-Chaves, Carlos; Aranda, Pilar; Llopis, Juan; Rodríguez-Diéguez, Antonio
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 6
• Pages of publication: 5387
• a: 9.1728 ± 0.0007 Å
• b: 23.781 ± 0.002 Å
• c: 8.3034 ± 0.0007 Å
• α: 90°
• β: 93.441 ± 0.001°
• γ: 90°
• Cell volume: 1808 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0403
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0893
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No