Information card for entry 7703707

Structure parameters

• Formula: C55 H79 B2 Ge2 N7
• Calculated formula: C55 H79 B2 Ge2 N7
• SMILES: [Ge]12([Ge](N(c3c(C)cccc3C)B(N1c1c(cccc1C)C)N(C(C)C)C(C)C)C#[N]C13CC4CC(C1)CC(C3)C4)N(c1c(C)cccc1C)B(N2c1c(cccc1C)C)N(C(C)C)C(C)C
• 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: 14.103 ± 0.0017 Å
• b: 22.561 ± 0.002 Å
• c: 18.11 ± 0.0018 Å
• α: 90°
• β: 112.285 ± 0.006°
• γ: 90°
• Cell volume: 5331.8 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1291
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.1214
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No