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Information card for entry 4082152
Preview
Coordinates | 4082152.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C78 H75 La O9 Zn3 |
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Calculated formula | C78 H75 La O9 Zn3 |
SMILES | [La]12345([O]6[Zn]([O]1c1ccc7ccccc7c1c1c7ccccc7ccc1[O]2[Zn]([O]3c1ccc2ccccc2c1c1c2ccccc2ccc1[O]4[Zn]([O]5c1ccc2ccccc2c1c1c2ccccc2ccc16)CC)([O]1CCCC1)CC)([O]1CCCC1)CC)[O]1CCCC1 |
Title of publication | Synthesis and Catalytic Activity of Heterobimetallic Rare Earth‒Zinc Ethyl BINOLate Analogues of Shibasaki’s Catalysts |
Authors of publication | Nieto, Ismael; Wooten, Alfred J.; Robinson, Jerome R.; Carroll, Patrick J.; Schelter, Eric J.; Walsh, Patrick J. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 24 |
Pages of publication | 7431 |
a | 11.918 ± 0.005 Å |
b | 22.919 ± 0.009 Å |
c | 12.246 ± 0.004 Å |
α | 90° |
β | 90.891 ± 0.003° |
γ | 90° |
Cell volume | 3345 ± 2 Å3 |
Cell temperature | 143 ± 1 K |
Ambient diffraction temperature | 143 ± 1 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0685 |
Residual factor for significantly intense reflections | 0.0562 |
Weighted residual factors for significantly intense reflections | 0.1392 |
Weighted residual factors for all reflections included in the refinement | 0.151 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
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/4082152.html
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