Information card for entry 7200285

Structure parameters

• Formula: C10 H7 N3 O4 Zn
• Calculated formula: C10 H7 N3 O4 Zn
• Title of publication: Two new metal‒triazole-benzenedicarboxylate frameworks affording an uncommon 3,4-connected net and unique 4,6-connected rod packing: hydrothermal synthesis, structure, thermostability and luminescence studies
• Authors of publication: Luo, Feng; Che, Yun-xia; Zheng, Ji-min
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 6
• Pages of publication: 1097
• a: 11.288 ± 0.002 Å
• b: 9.671 ± 0.0019 Å
• c: 10.281 ± 0.002 Å
• α: 90°
• β: 97.79 ± 0.03°
• γ: 90°
• Cell volume: 1112 ± 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: 0.0271
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No