Information card for entry 4107552

Structure parameters

• Common name: [{(PNP2)Cu}2][SbF6]2, 2 CH2Cl2
• Formula: C74 H124 Cl4 Cu2 F12 N2 P4 Sb2
• Calculated formula: C74 H124 Cl4 Cu2 F12 N2 P4 Sb2
• Title of publication: Probing the Electronic Structures of [Cu2(μ-XR2)]n+ Diamond Cores as a Function of the Bridging X Atom (X = N or P) and Charge (n= 0, 1, 2)
• Authors of publication: Seth B. Harkins; Neal P. Mankad; Alexander J. M. Miller; Robert K. Szilagyi; Jonas C. Peters
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 3478 - 3485
• a: 19.101 ± 0.003 Å
• b: 21.849 ± 0.003 Å
• c: 20.734 ± 0.005 Å
• α: 90°
• β: 90.717 ± 0.014°
• γ: 90°
• Cell volume: 8652 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1041
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No