Information card for entry 4082579

Structure parameters

• Formula: C16 H25 Ga N2 O
• Calculated formula: C16 H25 Ga N2 O
• SMILES: [Ga]1(OCCN2C=1N(CC2)c1c(cc(cc1C)C)C)(C)C
• Title of publication: Dialkylgallium Complexes with Alkoxide and Aryloxide Ligands Possessing N-Heterocyclic Carbene Functionalities: Synthesis and Structure
• Authors of publication: Horeglad, Paweł; Ablialimov, Osman; Szczepaniak, Grzegorz; Dąbrowska, Anna Maria; Dranka, Maciej; Zachara, Janusz
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 1
• Pages of publication: 100
• a: 14.55464 ± 0.00018 Å
• b: 7.87134 ± 0.00009 Å
• c: 14.22468 ± 0.00016 Å
• α: 90°
• β: 97.631 ± 0.0011°
• γ: 90°
• Cell volume: 1615.21 ± 0.03 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 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: 0.0206
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.0525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No