Information card for entry 4345059

Structure parameters

• Formula: C27 H42 Cl Ga N2 O2
• Calculated formula: C27 H42 Cl Ga N2 O2
• SMILES: [Ga]12(Cl)(Oc3c(cc(cc3C[N]1(C)CC[N]2(C)C)C(C)(C)C)C(C)(C)C)OCc1ccccc1
• Title of publication: A Comparison of Gallium and Indium Alkoxide Complexes as Catalysts for Ring-Opening Polymerization of Lactide.
• Authors of publication: Kremer, Alexandre B.; Andrews, Ryan J.; Milner, Matthew J.; Zhang, Xu R.; Ebrahimi, Tannaz; Patrick, Brian O.; Diaconescu, Paula L.; Mehrkhodavandi, Parisa
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 1375 - 1385
• a: 13.7473 ± 0.0007 Å
• b: 16.7022 ± 0.0008 Å
• c: 12.3646 ± 0.0006 Å
• α: 90°
• β: 106.037 ± 0.003°
• γ: 90°
• Cell volume: 2728.6 ± 0.2 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 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: 0.0412
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.114
• Weighted residual factors for all reflections included in the refinement: 0.1224
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No