Information card for entry 7035494

Structure parameters

• Formula: C18 H29 N O
• Calculated formula: C18 H29 N O
• SMILES: Oc1c(cc(cc1)C(C)(C)C)CN(C)C1CCCCC1
• Title of publication: Designing ancillary ligands for heteroleptic/homoleptic zinc complex formation: synthesis, structures and application in ROP of lactides.
• Authors of publication: Jędrzkiewicz, D; Ejfler, J.; Gulia, N.; John, Ł; Szafert, S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 30
• Pages of publication: 13700 - 13715
• a: 6.519 ± 0.005 Å
• b: 26.13 ± 0.02 Å
• c: 9.596 ± 0.006 Å
• α: 90°
• β: 94.95 ± 0.04°
• γ: 90°
• Cell volume: 1629 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0721
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No