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Information card for entry 4079925
Preview
Coordinates | 4079925.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H33 Al Cl N3 O |
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Calculated formula | C28 H33 Al Cl N3 O |
SMILES | [Al]12(Oc3ccc(Cl)cc3c3[n]1c(ccc3)C(N2c1c(cccc1C(C)C)C(C)C)C)([N]#CC)C |
Title of publication | Phenolate Substituent Effects on Ring-Opening Polymerization of ε-Caprolactone by Aluminum Complexes Bearing 2-(Phenyl-2-olate)-6-(1-amidoalkyl)pyridine Pincers |
Authors of publication | Alkarekshi, Wafaa; Armitage, Andrew P.; Boyron, Olivier; Davies, Christopher J.; Govere, Matifadza; Gregory, Andrew; Singh, Kuldip; Solan, Gregory A. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 1 |
Pages of publication | 249 |
a | 9.2662 ± 0.0007 Å |
b | 22.9537 ± 0.0018 Å |
c | 25.349 ± 0.002 Å |
α | 90° |
β | 96.21 ± 0.002° |
γ | 90° |
Cell volume | 5359.9 ± 0.7 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0715 |
Residual factor for significantly intense reflections | 0.0494 |
Weighted residual factors for significantly intense reflections | 0.1324 |
Weighted residual factors for all reflections included in the refinement | 0.1414 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.976 |
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/4079925.html
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