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Information card for entry 4306434
Preview
Coordinates | 4306434.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [OPy)Ti(OPri)Cl2]2 |
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Formula | C18 H26 Cl4 N2 O4 Ti2 |
Calculated formula | C18 H26 Cl4 N2 O4 Ti2 |
SMILES | c1cccc2C[O]3[Ti](OC(C)C)(Cl)(Cl)([n]12)[O]1Cc2cccc[n]2[Ti]31(OC(C)C)(Cl)Cl |
Title of publication | Stepwise Modification of Titanium Alkoxy Chloride Compounds by Pyridine Carbinol |
Authors of publication | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez; Robin M. Sewell; Todd M. Alam; Sarah K. McIntyre |
Journal of publication | Inorganic Chemistry |
Year of publication | 2008 |
Journal volume | 47 |
Pages of publication | 10708 - 10717 |
a | 8.5829 ± 0.0005 Å |
b | 8.2354 ± 0.0005 Å |
c | 17.2773 ± 0.0011 Å |
α | 90° |
β | 95.08 ± 0.001° |
γ | 90° |
Cell volume | 1216.43 ± 0.13 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0331 |
Residual factor for significantly intense reflections | 0.0297 |
Weighted residual factors for significantly intense reflections | 0.0821 |
Weighted residual factors for all reflections included in the refinement | 0.0844 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4306434.html
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