Information card for entry 7703711

Structure parameters

• Formula: C55 H72 B2 F3 Ge2 N6 O
• Calculated formula: C52 H69 B2 F3 Ge2 N6 O
• SMILES: [Ge]1(N(B(N1c1c(cccc1C)C)N(C(C)C)C(C)C)c1c(cccc1C)C)C(=[O][Ge]1N(B(N1c1c(cccc1C)C)N(C(C)C)C(C)C)c1c(cccc1C)C)(C(F)(F)F)c1ccccc1
• Title of publication: Reactivity of boraguanidinato germylenes toward carbonyl compounds and isocyanides: C-O, C-F and C-N bond activation.
• Authors of publication: Böserle, Jiří; Jambor, Roman; RůŽička, Aleš; Erben, Milan; Dostál, Libor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 15
• Pages of publication: 4869 - 4877
• a: 17.935 ± 0.004 Å
• b: 13.777 ± 0.003 Å
• c: 22.017 ± 0.004 Å
• α: 90°
• β: 95.854 ± 0.008°
• γ: 90°
• Cell volume: 5412 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.1428
• Residual factor for significantly intense reflections: 0.0837
• Weighted residual factors for significantly intense reflections: 0.2252
• Weighted residual factors for all reflections included in the refinement: 0.2863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No