Information card for entry 4065979

Structure parameters

• Formula: C42 H67 Ge O P
• Calculated formula: C42 H67 Ge O P
• SMILES: [Ge]1(OC(=CCC1=Pc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)C)(C(C)(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C
• Title of publication: The Reactivity of Phosphagermaallene Mes*P═C═Ge(t-Bu)Tip toward Aldehydes and Ketones: an Experimental and Theoretical Study
• Authors of publication: Ouhsaine, F.; André, E.; Sotiropoulos, J. M.; Escudié, J.; Ranaivonjatovo, H.; Gornitzka, H.; Saffon, N.; Miqueu, K.; Lazraq, M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 11
• Pages of publication: 2566
• a: 10.0287 ± 0.0004 Å
• b: 14.7045 ± 0.0005 Å
• c: 14.8994 ± 0.0006 Å
• α: 102.737 ± 0.002°
• β: 106.859 ± 0.002°
• γ: 98.33 ± 0.002°
• Cell volume: 1999.02 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0835
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.0879
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No