Information card for entry 4336993

Structure parameters

• Formula: C38 H28 N4 O6 V
• Calculated formula: C38 H28 N4 O6 V
• SMILES: [V]1234(OC(=N[N]3=C(C)c3c(O1)ccc1ccccc31)c1c(O)cccc1)OC(=N[N]4=C(C)c1c(O2)ccc2ccccc12)c1c(O)cccc1
• Title of publication: Highly Stable Hexacoordinated Nonoxidovanadium(IV) Complexes of Sterically Constrained Ligands: Syntheses, Structure, and Study of Antiproliferative and Insulin Mimetic Activity
• Authors of publication: Subhashree P. Dash; Sagarika Pasayat; Saswati Bhakat; Satabdi Roy; Rupam Dinda; Edward R. T. Tiekink; Subhadip Mukhopadhyay; Sujit K. Bhutia; Manasi R. Hardikar; Bimba N. Joshi; Yogesh P. Patil; M. Nethaji
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 14096 - 14107
• a: 14.711 ± 0.004 Å
• b: 14.697 ± 0.004 Å
• c: 15.068 ± 0.004 Å
• α: 90°
• β: 96.59 ± 0.004°
• γ: 90°
• Cell volume: 3236.3 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1458
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1376
• Weighted residual factors for all reflections included in the refinement: 0.1736
• 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