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Information card for entry 4084027
Preview
Coordinates | 4084027.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H38 Cl6 Hf2 |
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Calculated formula | C28 H38 Cl6 Hf2 |
SMILES | [C@@H]1([c]23[c]4([c]5([c]6([c]2(C(=C1C)C)[Hf]13456(Cl)(Cl)[Cl][Hf]2345([c]67[c]2([c]3([c]4([c]57C(=C([C@@H]6C)C)C)C)C)C)(Cl)(Cl)[Cl]1)C)C)C)C |
Title of publication | Chiral Group 4 Cyclopentadienyl Complexes and Their Use in Polymerization of Lactide Monomers |
Authors of publication | Turner, Zoë R.; Buffet, Jean-Charles; O’Hare, Dermot |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 14 |
Pages of publication | 3891 |
a | 8.7904 ± 0.0002 Å |
b | 17.573 ± 0.0004 Å |
c | 11.0616 ± 0.0003 Å |
α | 90° |
β | 112.495 ± 0.001° |
γ | 90° |
Cell volume | 1578.71 ± 0.07 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0792 |
Residual factor for significantly intense reflections | 0.0514 |
Weighted residual factors for significantly intense reflections | 0.1051 |
Weighted residual factors for all reflections included in the refinement | 0.1184 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
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/4084027.html
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Users of the data should acknowledge the original authors of the
structural data.