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Information card for entry 4331652
Preview
Coordinates | 4331652.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H80 Co2 O31 P8 Ti2 |
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Calculated formula | C34 H80 Co2 O31 P8 Ti2 |
SMILES | [cH]12[cH]3[cH]4[cH]5[cH]1[Co]162345[P](O[Ti]23(O[P]1(OCC)OCC)(O[P]6(OCC)OCC)O[Ti]145(O[P](=O)(O2)O[P](=O)(O5)O3)O[P]([Co]2356([cH]7[cH]6[cH]5[cH]3[cH]27)([P](O1)(OCC)OCC)[P](O4)(OCC)OCC)(OCC)OCC)(OCC)OCC.O.O.O.O.O |
Title of publication | Phosphato, Chromato, and Perrhenato Complexes of Titanium(IV) and Zirconium(IV) Containing Kläui's Tripodal Ligand |
Authors of publication | Yi,; Zhang, Qian-Feng; Lam, Tony C. H.; Chan, Eddie Y. Y.; Williams, Ian D.; Leung, Wa-Hung |
Journal of publication | Inorganic Chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 1 |
Pages of publication | 328 - 335 |
a | 17.615 ± 0.004 Å |
b | 18.853 ± 0.004 Å |
c | 19.594 ± 0.004 Å |
α | 90° |
β | 114.652 ± 0.005° |
γ | 90° |
Cell volume | 5914 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.1165 |
Residual factor for significantly intense reflections | 0.0613 |
Weighted residual factors for significantly intense reflections | 0.1173 |
Weighted residual factors for all reflections included in the refinement | 0.1373 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
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/4331652.html
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Users of the data should acknowledge the original authors of the
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