Information card for entry 4329097

Structure parameters

• Chemical name: catena-4,4'-bipyrazolato-cu(ii) acetonitrile solvate
• Formula: C8 H7 Cu N5
• Calculated formula: C8 H7 Cu N5
• Title of publication: Novel Coordination Frameworks Incorporating the 4,4'-Bipyrazolyl Ditopic Ligand
• Authors of publication: Claudio Pettinari; Aurel Tăbăcaru; Ishtvan Boldog; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 5235 - 5245
• a: 15.7895 ± 0.0013 Å
• b: 7.13275 ± 0.00055 Å
• c: 8.72068 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 982.15 ± 0.13 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 74
• Hermann-Mauguin space group symbol: I m m a
• Hall space group symbol: -I 2b 2
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No