Information card for entry 7211158

Structure parameters

• Formula: C92 H78 Cl6 Cu6 N16 O37 S6
• Calculated formula: C92 H68 Cl6 Cu6 N16 O37 S6
• Title of publication: Transition metal-directed assembly of diverse coordination polymers based on multifunctional ligand 2,4-dichloro-5-sulfamoylbenzoic acid
• Authors of publication: Zhao, Fangfang; Zhang, Guangju; Dong, Huan; Ji, Wenbin; Zhou, Lei; Li, Hao; Hu, Hailiang; Liu, Yang; Kang, Zhenhui
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 42
• Pages of publication: 8483
• a: 10.642 ± 0.0011 Å
• b: 16.0895 ± 0.0016 Å
• c: 18.2984 ± 0.0019 Å
• α: 64.614 ± 0.002°
• β: 89.078 ± 0.002°
• γ: 79.539 ± 0.002°
• Cell volume: 2776.8 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0762
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.0983
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No