Information card for entry 4100601

Structure parameters

• Formula: C6 H12 Cu N3 O
• Calculated formula: C6 H12 Cu N3 O1.01
• Title of publication: Copper(I) 1,2,4-Triazolates and Related Complexes: Studies of the Solvothermal Ligand Reactions, Network Topologies, and Photoluminescence Properties
• Authors of publication: Zhang, Jie-Peng; Lin, Yan-Yong; Huang, Xiao-Chun; Chen, Xiao-Ming
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 14.9159 ± 0.0007 Å
• b: 14.9159 ± 0.0007 Å
• c: 14.9159 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3318.6 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 204
• Hermann-Mauguin space group symbol: I m -3
• Hall space group symbol: -I 2 2 3
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No