Information card for entry 7037743

Structure parameters

• Formula: C65 H84 Ga2 N4 P2 Si2
• Calculated formula: C65 H84 Ga2 N4 P2 Si2
• SMILES: C1(=[GaH]2P([Si](C(C)(C)C)(c3ccccc3)c3ccccc3)[GaH](=C3N(C(C)C)c4c(cccc4)N3C(C)C)[P]2[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)N(C(C)C)c2c(cccc2)N1C(C)C.Cc1ccccc1
• Title of publication: Cyclic NHC-stabilized silylphosphinoalanes and -gallanes.
• Authors of publication: Kapitein, Manuel; Balmer, Markus; Niemeier, Lukas; von Hänisch, Carsten
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6275 - 6281
• a: 16.4 ± 0.01 Å
• b: 20.163 ± 0.006 Å
• c: 19.244 ± 0.012 Å
• α: 90°
• β: 94.09 ± 0.05°
• γ: 90°
• Cell volume: 6347 ± 6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0881
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.1483
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No