Information card for entry 4083569

Structure parameters

• Common name: Moris-326 (Naveen)
• Formula: C34 H38 Cl2 Hf N4 O2
• Calculated formula: C34 H38 Cl2 Hf N4 O2
• SMILES: [Hf]123(Cl)(Cl)([O](c4c([N]2=CN3c2c(cc(cc2C)C)C)cccc4)C)[N](=CN1c1c(cc(cc1C)C)C)c1c(OC)cccc1
• 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: 14.809 ± 0.001 Å
• b: 12.1569 ± 0.0009 Å
• c: 18.395 ± 0.001 Å
• α: 90°
• β: 98.284 ± 0.002°
• γ: 90°
• Cell volume: 3277.1 ± 0.4 ų
• Cell temperature: 240 ± 2 K
• Ambient diffraction temperature: 240 ± 2 K
• Number of distinct elements: 6
• 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: 0.0244
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0516
• Weighted residual factors for all reflections included in the refinement: 0.0534
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No