Information card for entry 7238308

Structure parameters

• Formula: C46 H40 Cu2 N8 O12 S4
• Calculated formula: C46 H40 Cu2 N8 O12 S4
• Title of publication: A series of metal‒organic coordination polymers assembled with disulfide ligand involving in situ cleavage of S‒S under co-ligand intervention
• Authors of publication: Zhang, Ya-Nan; Wang, Yao-Yu; Hou, Lei; Liu, Ping; Liu, Jian-Qiang; Shi, Qi-Zhen
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 11
• Pages of publication: 3840
• a: 9.3823 ± 0.0012 Å
• b: 12.2541 ± 0.0016 Å
• c: 12.379 ± 0.003 Å
• α: 113.038 ± 0.003°
• β: 92.382 ± 0.003°
• γ: 112.13 ± 0.002°
• Cell volume: 1183 ± 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: 0.0457
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No