Information card for entry 4510549

Structure parameters

• Common name: Cunpz
• Chemical name: Trimeric copper(I) 4-nitropyrazolate
• Formula: C9 H6 Cu3 N9 O6
• Calculated formula: C9 H6 Cu3 N9 O6
• Title of publication: Bending by Faulting: A Multiple Scale Study of Copper and Silver Nitropyrazolates
• Authors of publication: Bertolotti, Federica; Maspero, Angelo; Cervellino, Antonio; Guagliardi, Antonietta; Masciocchi, Norberto
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 6
• Pages of publication: 2913
• a: 19.8406 ± 0.0049 Å
• b: 11.4434 ± 0.0018 Å
• c: 3.53756 ± 0.00099 Å
• α: 90°
• β: 104.545 ± 0.029°
• γ: 90°
• Cell volume: 777.4 ± 0.3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.775276 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No