Information card for entry 1518981

Structure parameters

• Common name: [PNONPCrCl]2
• Formula: C52 H80 Cl2 Cr2 N4 O2 P4
• Calculated formula: C52 H80 Cl2 Cr2 N4 O2 P4
• Title of publication: Synthesis and redox reactivity of a phosphine-ligated dichromium paddlewheel
• Authors of publication: Reed J. Eisenhart; Rebecca K. Carlson; Kelsey M. Boyle; Laura Gagliardi; Connie C. Lu
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2015
• Journal volume: 424
• Pages of publication: 336 - 344
• a: 21.646 ± 0.0014 Å
• b: 21.646 ± 0.0014 Å
• c: 37.995 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 15417.4 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.065
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1543
• Weighted residual factors for all reflections included in the refinement: 0.1647
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No