Information card for entry 4083566

Structure parameters

• Common name: Moris-320 (Naveen)
• Formula: C36 H59 N6 Ti
• Calculated formula: C36 H59 N6 Ti
• SMILES: [Ti]12([N](=CN1c1c(cccc1C(C)C)C(C)C)C(C)C)([N](=CN2c1c(cccc1C(C)C)C(C)C)C(C)C)(N(C)C)N(C)C
• Title of publication: Asymmetric Bis(formamidinate) Group 4 Complexes: Synthesis, Structure and Their Reactivity in the Polymerization of α-Olefins.
• Authors of publication: Kulkarni, Naveen V.; Elkin, Tatyana; Tumaniskii, Boris; Botoshansky, Mark; Shimon, Linda J. W.; Eisen, Moris S.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 12
• Pages of publication: 3119
• a: 13.66 ± 0.003 Å
• b: 18.147 ± 0.004 Å
• c: 19.029 ± 0.004 Å
• α: 104.31 ± 0.03°
• β: 109.81 ± 0.03°
• γ: 109.64 ± 0.03°
• Cell volume: 3817 ± 2 ų
• Cell temperature: 250 ± 1 K
• Ambient diffraction temperature: 250 ± 1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1366
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1799
• Weighted residual factors for all reflections included in the refinement: 0.2086
• Goodness-of-fit parameter for all reflections included in the refinement: 0.899
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No