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Information card for entry 4081868
Preview
Coordinates | 4081868.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H41 N5 Ti |
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Calculated formula | C25 H41 N5 Ti |
SMILES | [Ti]1(N(c2c(cc(cc2C)C)C)C=[N]1c1c(cc(cc1C)C)C)(N(C)C)(N(C)C)N(C)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 | 11.4964 ± 0.0005 Å |
b | 14.7129 ± 0.0007 Å |
c | 17.2314 ± 0.0008 Å |
α | 91.371 ± 0.002° |
β | 107.04 ± 0.002° |
γ | 108.593 ± 0.002° |
Cell volume | 2619 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.049 |
Residual factor for significantly intense reflections | 0.0354 |
Weighted residual factors for significantly intense reflections | 0.0842 |
Weighted residual factors for all reflections included in the refinement | 0.0901 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4081868.html
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