Information card for entry 7239926

Structure parameters

• Formula: C18 H22 Cl2 Cu N4 O4 S2
• Calculated formula: C18 H22 Cl2 Cu N4 O4 S2
• Title of publication: Two groups of copperII pyridine‒triazole complexes with “open or close” pepper rings and their in vitro antitumor activities
• Authors of publication: Hong, ZhaoGuo; Zheng, Chu; Luo, Bi; You, Xin; Bian, HeDong; Liang, Hong; Chen, ZhenFeng; Huang, FuPing
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 11
• Pages of publication: 6297 - 6305
• a: 9.6197 ± 0.0012 Å
• b: 22.809 ± 0.003 Å
• c: 13.0632 ± 0.0012 Å
• α: 90°
• β: 127.446 ± 0.006°
• γ: 90°
• Cell volume: 2275.6 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 7
• 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: 0.0325
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No