Information card for entry 4314287

Structure parameters

• Chemical name: tetrakis(N,N'-di-p-anisylformamidinato)divanadium(II,II)
• Formula: C60 H60 N8 O8 V2
• Calculated formula: C60 H60 N8 O8 V2
• SMILES: c1(ccc(cc1)OC)[N]1[V]234[N](c5ccc(cc5)OC)=CN(c5ccc(cc5)OC)[V]4(N(C=[N]2c2ccc(OC)cc2)c2ccc(cc2)OC)(N(c2ccc(OC)cc2)C=[N]3c2ccc(OC)cc2)N(c2ccc(OC)cc2)C=1
• Title of publication: New Chemistry of the Triply Bonded Divanadium (V24+) Unit and Reduction to an Unprecedented V23+ Core
• Authors of publication: F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo; Xiaoping Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6063 - 6070
• a: 10.2646 ± 0.0006 Å
• b: 10.3332 ± 0.0006 Å
• c: 13.9625 ± 0.0009 Å
• α: 80.265 ± 0.001°
• β: 75.071 ± 0.001°
• γ: 81.16 ± 0.001°
• Cell volume: 1400.9 ± 0.15 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.048
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1039
• Weighted residual factors for all reflections included in the refinement: 0.1102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No