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Information card for entry 7007451
Preview
Coordinates | 7007451.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H21 Cl2 N O2 S Ti |
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Calculated formula | C21 H21 Cl2 N O2 S Ti |
SMILES | [Ti]123456([O]=S(=O)(N1c1c([c]37[c]4([c]5([cH]6[c]72C)C)C)cccc1)c1ccc(cc1)C)(Cl)Cl |
Title of publication | o-Phenylene-bridged Cp/sulfonamido titanium complexes for ethylene/1-octene copolymerization. |
Authors of publication | Joe, Dae June; Wu, Chun Ji; Bok, Taekki; Lee, Eun Jung; Lee, Choong Hoon; Han, Won-Sik; Kang, Sang Ook; Lee, Bun Yeoul |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 33 |
Pages of publication | 4056 - 4062 |
a | 11.194 ± 0.004 Å |
b | 9.734 ± 0.003 Å |
c | 19.677 ± 0.007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2144.1 ± 1.3 Å3 |
Cell temperature | 233 ± 2 K |
Ambient diffraction temperature | 233 ± 2 K |
Number of distinct elements | 7 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1561 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1429 |
Weighted residual factors for all reflections included in the refinement | 0.2004 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/7007451.html
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