Information card for entry 7710712

Structure parameters

• Formula: C16 H15 Cl4 N2 O2 Rh S
• Calculated formula: C16 H15 Cl4 N2 O2 Rh S
• SMILES: [Rh]1([S](=O)(C)C)([n]2c(C3=Cc4c(OC3=[NH]1)ccc(Cl)c4)cccc2)(Cl)(Cl)Cl
• 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: 8.0657 ± 0.0007 Å
• b: 8.5631 ± 0.0007 Å
• c: 14.3996 ± 0.0012 Å
• α: 78.253 ± 0.003°
• β: 84.796 ± 0.003°
• γ: 86.95 ± 0.003°
• Cell volume: 969.08 ± 0.14 ų
• Cell temperature: 293 ± 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: 0.0625
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0752
• Weighted residual factors for all reflections included in the refinement: 0.0821
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No