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Information card for entry 7007449
Preview
Coordinates | 7007449.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H31 N3 O2 S Ti |
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Calculated formula | C24 H31 N3 O2 S Ti |
SMILES | [Ti]12345(N(S(=O)(=O)c6ccc(cc6)C)c6c(cccc6)[c]61[c]2([cH]3[cH]4[c]56C)C)(N(C)C)N(C)C |
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 | 31.743 ± 0.003 Å |
b | 11.5195 ± 0.0011 Å |
c | 13.1968 ± 0.0012 Å |
α | 90° |
β | 98.297 ± 0.002° |
γ | 90° |
Cell volume | 4775.1 ± 0.8 Å3 |
Cell temperature | 233 ± 2 K |
Ambient diffraction temperature | 233 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0566 |
Residual factor for significantly intense reflections | 0.0376 |
Weighted residual factors for significantly intense reflections | 0.0953 |
Weighted residual factors for all reflections included in the refinement | 0.1136 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
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/7007449.html
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