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Information card for entry 7026880
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Coordinates | 7026880.cif |
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Original paper (by DOI) | HTML |
Common name | (Tol2Bob)Ti(OTf)2 . 2 CDCl3 |
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Chemical name | (2,2'-Biphenyl-bis(4-p-tolyl-2,4-butanedionato))- bis(trifluoromethanesulfonato)titanium(IV) dideuterochloroform solvate |
Formula | C38 H28 Cl6 D2 F6 O10 S2 Ti |
Calculated formula | C38 H30 Cl6 F6 O10 S2 Ti |
Title of publication | Optically active bis(β-diketonate) complexes of titanium. |
Authors of publication | Kongprakaiwoot, Natcharee; Armstrong, Jack B.; Noll, Bruce C.; Brown, Seth N. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 42 |
Pages of publication | 10105 - 10115 |
a | 11.1948 ± 0.0005 Å |
b | 14.8069 ± 0.0007 Å |
c | 16.0008 ± 0.0008 Å |
α | 62.997 ± 0.002° |
β | 71.233 ± 0.003° |
γ | 78.832 ± 0.003° |
Cell volume | 2233.95 ± 0.19 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0617 |
Residual factor for significantly intense reflections | 0.0428 |
Weighted residual factors for significantly intense reflections | 0.1008 |
Weighted residual factors for all reflections included in the refinement | 0.1107 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7026880.html
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