Information card for entry 1561618

Structure parameters

• Formula: C26 H21 N6 O15 S Zn2
• Calculated formula: C26 H21 N6 O15 S Zn2
• 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: 10.0991 ± 0.0006 Å
• b: 15.9353 ± 0.0009 Å
• c: 20.1512 ± 0.0011 Å
• α: 90°
• β: 93.981 ± 0.002°
• γ: 90°
• Cell volume: 3235.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0512
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No