Information card for entry 4302911

Structure parameters

• Formula: C33 H50 Ge N4 Si
• Calculated formula: C33 H50 Ge N4 Si
• SMILES: [Ge]1(N(c2c(cccc2C(C)C)C(C)C)C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)C(=N#N)[Si](C)(C)C
• Title of publication: Dehydrogenation of LGeH by a Lewis N-Heterocyclic Carbene Borane Pair under the Formation of L'Ge and its Reactions with B(C6F5)3 and Trimethylsilyl Diazomethane: An Unprecedented Rearrangement of a Diazocompound to an Isonitrile
• Authors of publication: Anukul Jana; Ina Objartel; Herbert W. Roesky; Dietmar Stalke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 7645 - 7649
• a: 10.7432 ± 0.0004 Å
• b: 12.0091 ± 0.0005 Å
• c: 14.5066 ± 0.0006 Å
• α: 106.928 ± 0.001°
• β: 94.246 ± 0.001°
• γ: 109.478 ± 0.001°
• Cell volume: 1657.36 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0273
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No