Information card for entry 7248231

Structure parameters

• Formula: C38 H50 N8 O9 Zn
• Calculated formula: C38 H50 N8 O9 Zn
• Title of publication: Consequences of twisting of the flexible arms of imidazole-derived urea in zinc-dicarboxylate coordination polymers
• Authors of publication: Verma, Satyendra; Brahma, Rinki; Baruah, Jubaraj B.
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 1976 - 1985
• a: 16.0036 ± 0.001 Å
• b: 9.549 ± 0.0006 Å
• c: 27.2906 ± 0.0017 Å
• α: 90°
• β: 100.52 ± 0.002°
• γ: 90°
• Cell volume: 4100.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1068
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for significantly intense reflections: 0.1106
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No