Information card for entry 1561616

Structure parameters

• Formula: C20 H24 Cd N4 O12 S
• Calculated formula: C20 H24 Cd N4 O12 S
• Title of publication: Structural diversity and fluorescence properties of three 2-sulfoterephthalate CdII/ZnII coordination polymers employing 1,4-bisbenzimidazole
• Authors of publication: Ren, Yixia; Chai, Hongmei; Tang, Long; Hou, Xiangyang; Wang, Jijiang
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2016
• Journal volume: 234
• Pages of publication: 103 - 109
• a: 7.8741 ± 0.0011 Å
• b: 9.0834 ± 0.0013 Å
• c: 19.283 ± 0.003 Å
• α: 101.181 ± 0.002°
• β: 92.501 ± 0.002°
• γ: 111.959 ± 0.002°
• Cell volume: 1244.6 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0553
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No