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Information card for entry 4067412
Preview
Coordinates | 4067412.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H40 Cl2 O3 Si2 Ti2 |
---|---|
Calculated formula | C30 H40 Cl2 O3 Si2 Ti2 |
SMILES | [Ti]123456789(O[Si]%10%11(O[Si]%10(O[Ti]%10%12%13%14%15%16%17%18(Cl)([cH]%19[cH]%14[cH]%13[cH]%12[cH]%10%19)[c]%10%11[c]%15([c]%16([c]%17([c]%18%10C)C)C)C)([c]%105[c]9([c]8([c]7([c]6%10C)C)C)C)C)C)(Cl)[cH]5[cH]1[cH]2[cH]3[cH]45 |
Title of publication | Dinuclear Dicyclopentadienyl Titanium Complexes with Bridging Cyclopentadienylsiloxo Ligands |
Authors of publication | Postigo, Lorena; Bellarosa, Luca; Sánchez-Nieves, Javier; Royo, Pascual; Lledós, Agustí; Mosquera, Marta E. G. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 3 |
Pages of publication | 642 |
a | 12.537 ± 0.008 Å |
b | 15.206 ± 0.008 Å |
c | 16.338 ± 0.009 Å |
α | 90° |
β | 101.59 ± 0.05° |
γ | 90° |
Cell volume | 3051 ± 3 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1407 |
Residual factor for significantly intense reflections | 0.0885 |
Weighted residual factors for significantly intense reflections | 0.2215 |
Weighted residual factors for all reflections included in the refinement | 0.2561 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
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/4067412.html
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Users of the data should acknowledge the original authors of the
structural data.