Information card for entry 7233842

Structure parameters

• Formula: C H8 Cl N3 O
• Calculated formula: C H8 Cl N3 O
• Title of publication: CO(NH2)2·NH4Cl: an ultraviolet birefringent material with conjugated CO groups
• Authors of publication: Wang, Ya; Han, Jian; Tudi, Abudukadi; Zhang, Zhizhong; Yang, Zhihua; Pan, Shilie
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 40
• Pages of publication: 6072
• a: 7.909 ± 0.003 Å
• b: 17.113 ± 0.006 Å
• c: 8.049 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1089.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 53
• Hermann-Mauguin space group symbol: P m n a
• Hall space group symbol: -P 2ac 2
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1213
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No