Information card for entry 7108084

Structure parameters

• Formula: C33 H27 Cl N2 O7 V
• Calculated formula: C33 H27 Cl N2 O7 V
• SMILES: c1ccc2c3c4c(cc2)ccc[n]4[V]2([n]13)(OC(=CC(/C=C/c1ccc(c(c1)OC)O)=[O]2)/C=C/c1ccc(c(c1)OC)O)(=O)Cl
• Title of publication: Remarkable photocytotoxicity of curcumin in HeLa cells in visible light and arresting its degradation on oxovanadium(IV) complex formation
• Authors of publication: Samya Banerjee; Puja Prasad; Akhtar Hussain; Imran Khan; Paturu Kondaiah; Akhil R. Chakravarty
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7702
• a: 9.3606 ± 0.0011 Å
• b: 12.8152 ± 0.0018 Å
• c: 16.3781 ± 0.0019 Å
• α: 102.249 ± 0.011°
• β: 101.851 ± 0.01°
• γ: 104.124 ± 0.011°
• Cell volume: 1792.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1775
• Residual factor for significantly intense reflections: 0.105
• Weighted residual factors for significantly intense reflections: 0.234
• Weighted residual factors for all reflections included in the refinement: 0.2726
• Goodness-of-fit parameter for all reflections included in the refinement: 0.912
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No