Information card for entry 4343071

Structure parameters

• Common name: n/a
• Chemical name: CP3CoN2
• Formula: C37 H54 Co N2 P3
• Calculated formula: C37 H54 Co N2 P3
• Title of publication: Evaluating Molecular Cobalt Complexes for the Conversion of N2 to NH3.
• Authors of publication: Del Castillo, Trevor J.; Thompson, Niklas B.; Suess, Daniel L. M.; Ung, Gaël; Peters, Jonas C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 19
• Pages of publication: 9256 - 9262
• a: 19.372 ± 0.0004 Å
• b: 19.372 ± 0.0004 Å
• c: 48.1269 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 15641.1 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.0738
• Weighted residual factors for significantly intense reflections: 0.191
• Weighted residual factors for all reflections included in the refinement: 0.2046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No