Information card for entry 7012925

Structure parameters

• Formula: C12 H10 Cu N2 O4
• Calculated formula: C12 H10 Cu N2 O4
• Title of publication: Cu(HCO2)2L {L = pyrazine, 4,4?-bipyridine}: employing the formate anion as a building block in three-dimensional coordination polymersElectronic supplementary information (ESI) available: Table S1, Exponents and valence shell ionization potentials. See http://www.rsc.org/suppdata/dt/b3/b302631k/
• Authors of publication: Manson, Jamie L.; Lecher, Jana G.; Gu, Jiyeong; Geiser, Urs; Schlueter, John A.; Henning, Robert; Wang, Xiaoping; Schultz, Arthur J.; Koo, Hyun-Joo; Whangbo, Myung-Hwan
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 14
• Pages of publication: 2905
• a: 7.8534 ± 0.0002 Å
• b: 7.8534 ± 0.0002 Å
• c: 18.4799 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1139.76 ± 0.06 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0267
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No