Information card for entry 7704891

Structure parameters

• Formula: C27 H37 Cl2 Ga N2
• Calculated formula: C27 H37 Cl2 Ga N2
• SMILES: [GaH](=C1N(c2c(cccc2C(C)C)C(C)C)C=CN1c1c(cccc1C(C)C)C(C)C)(Cl)Cl
• Title of publication: N-Heterocyclic carbene and cyclic (alkyl)(amino)carbene adducts of gallium hydrides, gallium chlorides and gallium hydrochlorides.
• Authors of publication: Hock, Andreas; Werner, Luis; Luz, Christian; Radius, Udo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 32
• Pages of publication: 11108 - 11119
• a: 16.4027 ± 0.0002 Å
• b: 19.2302 ± 0.0002 Å
• c: 18.9987 ± 0.0002 Å
• α: 90°
• β: 111.717 ± 0.001°
• γ: 90°
• Cell volume: 5567.36 ± 0.11 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0404
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0958
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No