Information card for entry 4105461

Structure parameters

• Common name: {[Me2NN]Cu}2(m-h2:h1-ONPh)
• Formula: C48 H55 Cu2 N5 O
• Calculated formula: C48 H55 Cu2 N5 O
• SMILES: [Cu]12(N(C(=CC(=[N]1c1c(C)cccc1C)C)C)c1c(C)cccc1C)O[N]2([Cu]1N(C(=CC(=[N]1c1c(cccc1C)C)C)C)c1c(cccc1C)C)c1ccccc1
• Title of publication: Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts
• Authors of publication: Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 18105 - 18111
• a: 16.0009 ± 0.0014 Å
• b: 11.3762 ± 0.001 Å
• c: 23.591 ± 0.002 Å
• α: 90°
• β: 90.729 ± 0.001°
• γ: 90°
• Cell volume: 4293.9 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No