Information card for entry 7046725

Structure parameters

• Formula: C28 H29 N5 O9 V
• Calculated formula: C28 H29 N5 O9 V
• Title of publication: Synthesis, in vitro cytotoxicity, and structure-activity relationships (SAR) of multidentate oxidovanadium(iv) complexes as anticancer agents.
• Authors of publication: Ni, Lubin; Zhao, Hongxia; Tao, Li; Li, Xing; Zhou, Zhaohui; Sun, Yun; Chen, Chong; Wei, Duo; Liu, Yanqing; Diao, Guowang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 10035 - 10045
• a: 7.1555 ± 0.0005 Å
• b: 19.6759 ± 0.0012 Å
• c: 19.8619 ± 0.0013 Å
• α: 90°
• β: 95.826 ± 0.007°
• γ: 90°
• Cell volume: 2781.9 ± 0.3 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0887
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No