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Information card for entry 4122822
Preview
Coordinates | 4122822.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H28 O4 P2 |
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Calculated formula | C28 H28 O4 P2 |
SMILES | c1(ccc(cc1)OC)P(c1ccc(OC)cc1)P(c1ccc(cc1)OC)c1ccc(OC)cc1 |
Title of publication | Selective dehydrocoupling of phosphines by lithium chloride carbenoids. |
Authors of publication | Molitor, Sebastian; Becker, Julia; Gessner, Viktoria H. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 44 |
Pages of publication | 15517 - 15520 |
a | 24.4088 ± 0.0015 Å |
b | 6.4226 ± 0.0004 Å |
c | 16.4976 ± 0.001 Å |
α | 90° |
β | 107.496 ± 0.002° |
γ | 90° |
Cell volume | 2466.6 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0331 |
Residual factor for significantly intense reflections | 0.0289 |
Weighted residual factors for significantly intense reflections | 0.0799 |
Weighted residual factors for all reflections included in the refinement | 0.0834 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
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/4122822.html
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