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Information card for entry 4063973
Preview
Coordinates | 4063973.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H30 Al N5 S |
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Calculated formula | C22 H30 Al N5 S |
SMILES | c1(cc(C)[n]2n1C(C(=S)N(c1ccccc1)[Al]2(CC)CC)n1c(cc(C)n1)C)C |
Title of publication | Neutral and Cationic Aluminum Complexes Supported by Acetamidate and Thioacetamidate Heteroscorpionate Ligands as Initiators for Ring-Opening Polymerization of Cyclic Esters |
Authors of publication | Otero, Antonio; Lara-Sánchez, Agustín; Fernández-Baeza, Juan; Alonso-Moreno, Carlos; Castro-Osma, Jose A.; Márquez-Segovia, I.; Sánchez-Barba, Luis F.; Rodríguez, Ana M.; Garcia-Martinez, Joaquin C. |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 6 |
Pages of publication | 1507 |
a | 10.9497 ± 0.0013 Å |
b | 15.4316 ± 0.0016 Å |
c | 14.0254 ± 0.0019 Å |
α | 90° |
β | 100.569 ± 0.006° |
γ | 90° |
Cell volume | 2329.7 ± 0.5 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 5 |
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 | 0.1477 |
Residual factor for significantly intense reflections | 0.065 |
Weighted residual factors for significantly intense reflections | 0.1508 |
Weighted residual factors for all reflections included in the refinement | 0.2016 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.921 |
Diffraction radiation wavelength | 0.71073 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/4063973.html
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Users of the data should acknowledge the original authors of the
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