Information card for entry 4326837

Structure parameters

• Formula: C30 H23 Cl Cu N9 O8
• Calculated formula: C30 H23 Cl Cu N9 O8
• Title of publication: Copper(II)-Mediated Oxidative Transformation ofvic-Dioxime to Furoxan: Evidence for a Copper(II)-Dinitrosoalkene Intermediate
• Authors of publication: Oindrila Das; Sayantan Paria; Ennio Zangrando; Tapan Kanti Paine
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 11375 - 11383
• a: 8.907 ± 0.002 Å
• b: 10.053 ± 0.003 Å
• c: 17.151 ± 0.003 Å
• α: 83.664 ± 0.01°
• β: 80.11 ± 0.02°
• γ: 83.203 ± 0.01°
• Cell volume: 1495.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1154
• Residual factor for significantly intense reflections: 0.0774
• Weighted residual factors for significantly intense reflections: 0.2151
• Weighted residual factors for all reflections included in the refinement: 0.242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No