Information card for entry 7135365

Structure parameters

• Common name: Zinc 3-Amino-5-methyl-1,2,4-triazolato carbonate
• Chemical name: Zinc 3-Amino-5-methyl-1,2,4-triazolato carbonate
• Formula: C7 H10 N8 O3 Zn2
• Calculated formula: C7 H10 N8 O3 Zn2
• Title of publication: Understanding the potential of a new zinc-triazolato-carbonate metal-organic framework for humid CO2 capture process
• Authors of publication: Song, Ping; Stiles Wilkins, Nicholas; Taheri-Qazvini, Omid; Adeleke, Adebayo A.; Moghaddam, Alireza Lotfollahzade; Amirani, Morteza Chehel; Srinivasan, Karthik; Masoumifard, Nima; Ramanathan, Vaidhyanathan
• Journal of publication: Chemical Communications
• Year of publication: 2026
• a: 17.5097 ± 0.0003 Å
• b: 8.9985 ± 0.0002 Å
• c: 9.905 ± 0.0002 Å
• α: 90°
• β: 108.729 ± 0.001°
• γ: 90°
• Cell volume: 1478 ± 0.05 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0393
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.1436
• Weighted residual factors for all reflections included in the refinement: 0.1468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No