Information card for entry 4106946

Structure parameters

• Formula: C40 H71 Ge N5 P2
• Calculated formula: C40 H71 Ge N5 P2
• SMILES: [Ge]1C(=P2(N(CCN2C(C)C)C(C)C)C2=C(N1c1c(cccc1C(C)C)C(C)C)[C@@H]1CC[C@H]2C1)P(N(C(C)C)C(C)C)N(C(C)C)C(C)C.[Ge]1C(=P2(N(CCN2C(C)C)C(C)C)C2=C(N1c1c(cccc1C(C)C)C(C)C)[C@H]1CC[C@@H]2C1)P(N(C(C)C)C(C)C)N(C(C)C)C(C)C
• Title of publication: Synthesis and Reactivity of a Phosphine-Stabilized Monogermanium Analogue of Alkynes
• Authors of publication: Juliette Berthe; Juan Manuel Garcia; Edgar Ocando; Tsuyoshi Kato; Nathalie Saffon-Merceron; Abel De Cózar; Fernando P. Cossío; Antoine Baceiredo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 15930 - 15933
• a: 9.8517 ± 0.0004 Å
• b: 10.3538 ± 0.0004 Å
• c: 22.4488 ± 0.001 Å
• α: 85.48 ± 0.001°
• β: 81.329 ± 0.002°
• γ: 70.626 ± 0.001°
• Cell volume: 2134.46 ± 0.15 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0383
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0796
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No