Information card for entry 4069375

Structure parameters

• Common name: Amino Titanium
• Chemical name: Amino Titanium
• Formula: C32 H62 N6 Ti
• Calculated formula: C32 H62 N6 Ti
• SMILES: [Ti]12([N](C3CCCCC3)=C(N1C1CCCCC1)C)(N(C)C)([N](C1CCCCC1)=C(N2C1CCCCC1)C)N(C)C
• Title of publication: Synthesis and Characterization of Group 4 Amidinate Amide Complexes M[CyNC(Me)NCy]2(NR2)2(R = Me, M = Ti, Zr, Hf; R = Et, M = Zr)
• Authors of publication: Sun, Jia-Feng; Chen, Shu-Jian; Duan, Yuxi; Li, Yi-Zhi; Chen, Xue-Tai; Xue, Zi-Ling
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 10
• Pages of publication: 3088
• a: 10.522 ± 0.005 Å
• b: 9.264 ± 0.004 Å
• c: 18.163 ± 0.008 Å
• α: 90°
• β: 104.415 ± 0.005°
• γ: 90°
• Cell volume: 1714.7 ± 1.3 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.502
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No