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Information card for entry 4080225
Preview
Coordinates | 4080225.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C120 H116 La Na O15 |
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Calculated formula | C120 H116 La Na O15 |
SMILES | [O]1=C([O][La]23451([O](=C([O]2)C(c1ccccc1)(c1ccccc1)c1ccccc1)[Na]([O]3C(=[O]4)C(c1ccccc1)(c1ccccc1)c1ccccc1)([O]=C(O5)C(c1ccccc1)(c1ccccc1)c1ccccc1)([O]=C(O)C(c1ccccc1)(c1ccccc1)c1ccccc1)[O]1CCCC1)([O]1CCCC1)[O]1CCCC1)C(c1ccccc1)(c1ccccc1)c1ccccc1.O1CCCC1.C1CCCO1 |
Title of publication | Di- and Triphenylacetates of Lanthanum and Neodymium. Synthesis, Structural Diversity, and Application in Diene Polymerization |
Authors of publication | Roitershtein, Dmitrii M.; Vinogradov, Alexander A.; Vinogradov, Alexei A.; Lyssenko, Konstantin A.; Nelyubina, Yulia V.; Anan’ev, Ivan V.; Nifant’ev, Ilya E.; Yakovlev, Vladimir A.; Kostitsyna, Natalya N. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 5 |
Pages of publication | 1272 |
a | 14.4284 ± 0.0006 Å |
b | 18.495 ± 0.0007 Å |
c | 18.5519 ± 0.0007 Å |
α | 99.405 ± 0.001° |
β | 94.582 ± 0.001° |
γ | 91.468 ± 0.001° |
Cell volume | 4864.7 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0941 |
Residual factor for significantly intense reflections | 0.0522 |
Weighted residual factors for significantly intense reflections | 0.1001 |
Weighted residual factors for all reflections included in the refinement | 0.1194 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.949 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4080225.html
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