Information card for entry 7044626

Structure parameters

• Formula: C112 H84 B2 F48 N4 P2
• Calculated formula: C112 H84 B2 F48 N4 P2
• Title of publication: A Modular Approach to Carbene-Stabilized Diphosphorus Species
• Authors of publication: Doddi, Adinarayana; Bockfeld, Dirk; Zaretzke, Marc-Kevin; Kleeberg, Christian; Bannenberg, Thomas; Tamm, Matthias
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 16.1731 ± 0.0007 Å
• b: 19.4127 ± 0.001 Å
• c: 20.2655 ± 0.0001 Å
• α: 80.996 ± 0.004°
• β: 76.569 ± 0.004°
• γ: 69.481 ± 0.004°
• Cell volume: 5776.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.081
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1888
• Weighted residual factors for all reflections included in the refinement: 0.1997
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No