Information card for entry 4081866

Structure parameters

• Common name: Moris-310 (Naveen)
• Formula: C17 H20 N2 O2
• Calculated formula: C17 H20 N2 O2
• SMILES: O(c1c(/N=C(/Nc2c(OC)cccc2)CC)cccc1)C
• Title of publication: Synthesis and Structure of Group 4 Symmetric Amidinate Complexes and Their Reactivity in the Polymerization of α-Olefins
• Authors of publication: Elkin, Tatyana; Kulkarni, Naveen V.; Tumanskii, Boris; Botoshansky, Mark; Shimon, Linda J. W.; Eisen, Moris S.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 21
• Pages of publication: 6337
• a: 17.6866 ± 0.0005 Å
• b: 8.5898 ± 0.0002 Å
• c: 21.4512 ± 0.0006 Å
• α: 90°
• β: 105.985 ± 0.001°
• γ: 90°
• Cell volume: 3132.95 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0526
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1232
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 0.779
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No