Information card for entry 7710714

Structure parameters

• Formula: C24 H26 Cl3 N2 O2 Rh S
• Calculated formula: C24 H26 Cl3 N2 O2 Rh S
• SMILES: [Rh]1([S](=O)(C)C)(Cl)(Cl)(Cl)[NH]=C2Oc3c(cccc3C(C)(C)C)C=C2c2[n]1c1c(cccc1)cc2
• Title of publication: Cell nucleus localization and high anticancer activity of quinoline-benzopyran rhodium(III) metal complexes as therapeutic and fluorescence imaging agents.
• Authors of publication: Wang, Zhen-Feng; Nai, Xiao-Ling; Xu, Yue; Pan, Feng-Hua; Tang, Fu-Shun; Qin, Qi-Pin; Yang, Lin; Zhang, Shu-Hua
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• a: 8.3861 ± 0.0003 Å
• b: 11.4423 ± 0.0004 Å
• c: 13.9193 ± 0.0005 Å
• α: 78.158 ± 0.001°
• β: 88.814 ± 0.001°
• γ: 80.093 ± 0.001°
• Cell volume: 1287.58 ± 0.08 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No