Information card for entry 4324660

Structure parameters

• Formula: C51 H43 N9 O7 V2
• Calculated formula: C51 H34 N9 O7 V2
• Title of publication: o-Iminobenzosemiquinonate and o-Imino-p-methylbenzosemiquinonate Anion Radicals Coupled VO2+ Stabilization
• Authors of publication: Amit Saha Roy; Pinaki Saha; Nirmal Das Adhikary; Prasanta Ghosh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2488 - 2500
• a: 13.0735 ± 0.0009 Å
• b: 13.0842 ± 0.0009 Å
• c: 14.3558 ± 0.0018 Å
• α: 97.372 ± 0.002°
• β: 97.313 ± 0.002°
• γ: 111.245 ± 0.001°
• Cell volume: 2229.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0658
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections included in the refinement: 0.1587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No