Information card for entry 4112902

Structure parameters

• Common name: [Na]2[Dipp*Ge(mu-H)]2
• Formula: C60 H76 Ge2 Na2
• Calculated formula: C60 H76 Ge2 Na2
• SMILES: C(C)(c1c(c2c([Ge]34[H][Ge]4(c4c(cccc4c4c(cccc4C(C)C)C(C)C)c4c(cccc4C(C)C)C(C)C)[H]3)c(ccc2)c2c(C(C)C)cccc2C(C)C)c(ccc1)C(C)C)C.[Na+].[Na+]
• Title of publication: Reduction of Digermenes with Alkali Metals: Salts of Formula M2[{Ge(H)Ar'}2] (M = Li, Na, or K, Ar' = Terphenyl) with Three Different Structures
• Authors of publication: Anne F. Richards; Marcin Brynda; Philip P. Power
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 10530 - 10531
• a: 11.6034 ± 0.0015 Å
• b: 17.856 ± 0.002 Å
• c: 13.1893 ± 0.0017 Å
• α: 90°
• β: 100.058 ± 0.002°
• γ: 90°
• Cell volume: 2690.7 ± 0.6 ų
• Cell temperature: 91 ± 2 K
• Ambient diffraction temperature: 91 ± 2 K
• Number of distinct elements: 4
• 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: 0.0472
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No