Information card for entry 4312084

Structure parameters

• Formula: C44 H90 Ge2 N10 O5 Si8
• Calculated formula: C44 H90 Ge2 N10 O5 Si8
• SMILES: [Ge]1(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N2N=C(OCCCCO[Ge](OC3=NN1C(=O)N3c1ccccc1)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C2=O)c1ccccc1
• Title of publication: Synthesis of a Digermane-Containing Tricylic Nonadecadienedione Incorporating an Equivalent of Ring-Opened THF
• Authors of publication: Amy C. Gottfried; Jia Wang; Erin E. Wilson; Larry W. Beck; Mark M. Banaszak Holl; Jeff W. Kampf
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7665 - 7670
• a: 11.496 ± 0.003 Å
• b: 28.227 ± 0.007 Å
• c: 19.713 ± 0.005 Å
• α: 90°
• β: 94.416 ± 0.005°
• γ: 90°
• Cell volume: 6378 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0457
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections included in the refinement: 0.0745
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No