Information card for entry 7103180

Structure parameters

• Formula: C39 H66 N2 P5 Rh
• Calculated formula: C39 H66 N2 P5 Rh
• SMILES: [Rh]123(P(P([P]1(P(P2CC)CC)CC)CC)CC)[N](c1c(cccc1C(C)C)C(C)C)=C(C)C=C(N3c1c(cccc1C(C)C)C(C)C)C
• Title of publication: Activation of P5R5 (R = Ph, Et) by a Rh-beta-diketiminate complex.
• Authors of publication: Geier, Stephen J; Stephan, Douglas W
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 24
• Pages of publication: 2779 - 2781
• a: 12.7417 ± 0.0015 Å
• b: 17.733 ± 0.002 Å
• c: 19.684 ± 0.002 Å
• α: 90°
• β: 103.245 ± 0.001°
• γ: 90°
• Cell volume: 4329.3 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0661
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.148
• Weighted residual factors for all reflections included in the refinement: 0.1564
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No