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Information card for entry 4115949
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Coordinates | 4115949.cif |
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Original paper (by DOI) | HTML |
Formula | C65 H70 Ga Li O10 |
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Calculated formula | C65 H68 Ga Li O10 |
Title of publication | Catalytic Enantioselectivemeso-Epoxide Ring Opening Reaction with Phenolic Oxygen Nucleophile Promoted by Gallium Heterobimetallic Multifunctional Complexes |
Authors of publication | Shigeki Matsunaga; Jagattaran Das; Jochen Roels; Erasmus M. Vogl; Noriyoshi Yamamoto; Takehiko Iida; Kentaro Yamaguchi; Masakatsu Shibasaki |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2000 |
Journal volume | 122 |
Pages of publication | 2252 - 2260 |
a | 10.013 ± 0.005 Å |
b | 19.02 ± 0.01 Å |
c | 15.34 ± 0.01 Å |
α | 90° |
β | 106.32 ± 0.03° |
γ | 90° |
Cell volume | 2804 ± 3 Å3 |
Cell temperature | 135.2 K |
Ambient diffraction temperature | 135.2 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 | 0.0665 |
Residual factor for significantly intense reflections | 0.0665 |
Weighted residual factors for significantly intense reflections | 0.0771 |
Weighted residual factors for all reflections included in the refinement | 0.077 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.842 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4115949.cif |
120077 | 2014-07-12 | Adding DOIs to range 4/11 structures. | 4115949.cif |
70513 | 2012-12-26 | cif/ Adding structures of 4115949 via cif-deposit CGI script. |
4115949.cif |
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Users of the data should acknowledge the original authors of the
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