Information card for entry 7119291

Structure parameters

• Formula: C47 H50 Cu F6 N2 P
• Calculated formula: C47 H50 Cu F6 N2 P
• Title of publication: Nitric oxide release via oxygen atom transfer from nitrite at copper(ii).
• Authors of publication: Sakhaei, Zeinab; Kundu, Subrata; Donnelly, Jane M.; Bertke, Jeffery A.; Kim, William Y.; Warren, Timothy H.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2017
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 549 - 552
• a: 12.7356 ± 0.0003 Å
• b: 16.3289 ± 0.0004 Å
• c: 23.5452 ± 0.0006 Å
• α: 81.7 ± 0.001°
• β: 82.851 ± 0.001°
• γ: 73.675 ± 0.001°
• Cell volume: 4631.6 ± 0.2 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 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: 0.0453
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No