Information card for entry 7228658

Structure parameters

• Formula: C20 H21 N5 O6 Zn
• Calculated formula: C20 H21 N5 O6 Zn
• Title of publication: A series of transitional metal coordination polymers based on a rigid bi-functional carboxylate-triazolate tecton
• Authors of publication: li, bao; Mao, Nannan; hu, peng; Yu, Fan; Chen, Xi; Zhuang, Gui-lin; Zhang, Tianle
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 8.227 ± 0.0006 Å
• b: 21.5096 ± 0.0009 Å
• c: 23.8825 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4226.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0435
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No