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Information card for entry 7036258
Preview
Coordinates | 7036258.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H46 Ca O |
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Calculated formula | C30 H46 Ca O |
SMILES | [Ca]12345678([O]9CCCC9)(C[C]1(=[CH]2[C]13=[CH]4C[C@H]2C[C@@H]1C2(C)C)C)C[C]5(=[CH]6[C]17=[CH]8C[C@H]2C[C@@H]1C2(C)C)C |
Title of publication | Preparation of enantiomerically pure open calcocene and strontocene complexes and their application in ring opening polymerizations of rac-lactide. |
Authors of publication | Fecker, Ann Christin; Freytag, Matthias; Jones, Peter G.; Zhao, Ning; Zi, Guofu; Walter, Marc D. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 37 |
Pages of publication | 16325 - 16331 |
a | 13.5295 ± 0.0003 Å |
b | 13.7062 ± 0.0003 Å |
c | 15.0026 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2782.05 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0371 |
Residual factor for significantly intense reflections | 0.0336 |
Weighted residual factors for significantly intense reflections | 0.0811 |
Weighted residual factors for all reflections included in the refinement | 0.0831 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/7036258.html
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