Information card for entry 4319280

Structure parameters

• Formula: C20 H26 N O
• Calculated formula: C20 H25 N O
• SMILES: Oc1c(cccc1/C=N/c1c(cccc1C(C)C)C(C)C)C
• Title of publication: Bis-Salicylaldiminato Complexes of Zinc. Examination of the Catalyzed Epoxide/CO2 Copolymerization
• Authors of publication: Donald J. Darensbourg; Patrick Rainey; Jason Yarbrough
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 986 - 993
• a: 7.541 ± 0.003 Å
• b: 9.58 ± 0.004 Å
• c: 23.817 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1720.6 ± 1.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0513
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No