Information card for entry 2007967

Structure parameters

• Chemical name: {Methyl[2-cyano-2-(hydroxyimino)]ethanimidate}-bipyridine- nitrosodicyanomethanidecopper(II)
• Formula: C17 H12 Cu N8 O3
• Calculated formula: C17 H12 Cu N8 O3
• SMILES: [Cu]12([n]3c(cccc3)c3[n]1cccc3)(ON=C(C#N)C#N)NC(=C([N]2=O)C#N)OC
• Title of publication: Dicyanonitrosomethanide as a Subject of Nucleophilic Addition of Methanol and as an End-<i>O</i>-Coordinated Ligand in the Same Copper(II) Complex. II. (Bipyridine)(dicyanonitrosomethanido)[methyl(2-cyano-2-hydroxyimino)ethanimidato]copper(II)
• Authors of publication: Dunaj-Jurčo, Michal; Mikloš, Dušan; Potočňák, Ivan; Jäger, Lothar
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 1763 - 1765
• a: 20.118 ± 0.004 Å
• b: 8.358 ± 0.002 Å
• c: 23.444 ± 0.005 Å
• α: 90°
• β: 114.02 ± 0.03°
• γ: 90°
• Cell volume: 3600.7 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.178
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections: 0.693
• Goodness-of-fit parameter for all reflections included in the refinement: 0.957
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No