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Information card for entry 4087206
Preview
Coordinates | 4087206.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H22 Cl3 O P Te |
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Calculated formula | C18 H22 Cl3 O P Te |
SMILES | [Te]1(Cl)(Cl)(Cl)[O]=P(c2ccc3c4c(ccc1c24)CC3)(C(C)C)C(C)C |
Title of publication | Selective Oxidation and Functionalization of 6-Diphenylphosphinoacenaphthyl-5-tellurenyl Species 6-Ph2P-Ace-5-TeX (X = Mes, Cl, O3SCF3). Various Types of P‒E···Te(II,IV) Bonding Situations (E = O, S, Se) |
Authors of publication | Hupf, Emanuel; Do, Truong Giang; Nordheider, Andreas; Wehrhahn, Maren; Sanz Camacho, Paula; Ashbrook, Sharon E.; Lork, Enno; Slawin, Alexandra M. Z.; Mebs, Stefan; Woollins, J. Derek; Beckmann, Jens |
Journal of publication | Organometallics |
Year of publication | 2017 |
a | 9.2187 ± 0.0012 Å |
b | 11.8772 ± 0.0013 Å |
c | 18.454 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2020.6 ± 0.4 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 K |
Number of distinct elements | 6 |
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 | 0.0491 |
Residual factor for significantly intense reflections | 0.044 |
Weighted residual factors for significantly intense reflections | 0.1156 |
Weighted residual factors for all reflections included in the refinement | 0.1236 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
Diffraction radiation wavelength | 0.71075 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/4087206.html
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