Information card for entry 7036456

Structure parameters

• Formula: C37 H60 Ga N2 O4 P
• Calculated formula: C37 H60 Ga N2 O4 P
• SMILES: [GaH]1(OP(=O)(OCCCC)OCCCC)[N](=C(C)C=C(N1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis of substituted β-diketiminate gallium hydrides via oxidative addition of H-O bonds.
• Authors of publication: Herappe-Mejía, Eduardo; Trujillo-Hernández, Karla; Carlos Garduño-Jiménez, Juan; Cortés-Guzmán, Fernando; Martínez-Otero, Diego; Jancik, Vojtech
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 38
• Pages of publication: 16894 - 16902
• a: 33.6284 ± 0.0009 Å
• b: 11.9006 ± 0.0003 Å
• c: 19.1275 ± 0.0005 Å
• α: 90°
• β: 96.343 ± 0.002°
• γ: 90°
• Cell volume: 7607.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.063
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1006
• Weighted residual factors for all reflections included in the refinement: 0.1099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No