Information card for entry 1564620

Structure parameters

• Formula: C50 H65 N9 O13 Zn2
• Calculated formula: C50 H65 N9 O13 Zn2
• Title of publication: Two new coordination polymers driven by polycarboxylate and N-donor spacers: Photocatalytic performance and theoretical analysis
• Authors of publication: Lu, Lu; Wang, Jun; Zhou, Shanhe; Zhong, Yuyu; Sun, Yanchun; Wu, Xiren; Singh, Amita; Kumar, Abhinav
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 508
• Pages of publication: 119647
• a: 14.3581 ± 0.0011 Å
• b: 14.9372 ± 0.0012 Å
• c: 15.4232 ± 0.0012 Å
• α: 110.925 ± 0.001°
• β: 112.548 ± 0.001°
• γ: 98.7567 ± 0.001°
• Cell volume: 2688.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0886
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.1565
• Weighted residual factors for all reflections included in the refinement: 0.1764
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No