Information card for entry 4105463

Structure parameters

• Common name: [Me2NN]Cu(h2-ONPh)
• Formula: C27 H30 Cu N3 O
• Calculated formula: C27 H30 Cu N3 O
• SMILES: [Cu]12(N(c3c(C)cccc3C)C(=CC(=[N]1c1c(cccc1C)C)C)C)[O]=[N]2c1ccccc1
• 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: 11.752 ± 0.002 Å
• b: 33.35 ± 0.006 Å
• c: 12.6 ± 0.002 Å
• α: 90°
• β: 101.014 ± 0.002°
• γ: 90°
• Cell volume: 4847.3 ± 1.4 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.087
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1621
• Weighted residual factors for all reflections included in the refinement: 0.1713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No