Information card for entry 4319761

Structure parameters

• Common name: NacNacGaCl2
• Formula: C29 H41 Cl2 Ga N2
• Calculated formula: C29 H41 Cl2 Ga N2
• SMILES: [Ga]1(Cl)(Cl)[N](=C(C=C(N1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis and Characterization of HC{C(Me)N(C6H3-2,6-i-Pr2)}2MX2 (M = Al, X = Cl, I; M = Ga, In, X = Me, Cl, I): Sterically Encumbered β-Diketiminate Group 13 Metal Derivatives
• Authors of publication: Matthias Stender; Barrett E. Eichler; Ned J. Hardman; Philip P. Power; Jörg Prust; Mathias Noltemeyer; Herbert W. Roesky
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 2794 - 2799
• a: 17.0709 ± 0.0013 Å
• b: 13.0948 ± 0.001 Å
• c: 13.7356 ± 0.001 Å
• α: 90°
• β: 108.432 ± 0.002°
• γ: 90°
• Cell volume: 2912.9 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 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: 0.0564
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No