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Information card for entry 4080362
Preview
Coordinates | 4080362.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C65 H87 N2 O4 P2 Y |
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Calculated formula | C65 H87 N2 O4 P2 Y |
SMILES | [Y]123(Oc4c(P(=[N]2CC(C[N]3=P(c2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1)(C)C)(c1ccccc1)c1ccccc1)cc(cc4C(C)(C)C)C(C)(C)C)(OC(C)(C)C)[O]1CCCC1 |
Title of publication | Yttrium Phosphasalen Initiators forrac-Lactide Polymerization |
Authors of publication | Bakewell, Clare; Cao, Thi-Phuong-Anh; Le Goff, Xavier F.; Long, Nicholas J.; Auffrant, Audrey; Williams, Charlotte K. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 5 |
Pages of publication | 1475 |
a | 11.409 ± 0.001 Å |
b | 27.849 ± 0.001 Å |
c | 21.019 ± 0.001 Å |
α | 90° |
β | 113.905 ± 0.005° |
γ | 90° |
Cell volume | 6105.5 ± 0.7 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 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 | 0.086 |
Residual factor for significantly intense reflections | 0.0783 |
Weighted residual factors for significantly intense reflections | 0.1588 |
Weighted residual factors for all reflections included in the refinement | 0.1628 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.159 |
Diffraction radiation wavelength | 0.71069 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/4080362.html
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Users of the data should acknowledge the original authors of the
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