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Information card for entry 1503386
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Coordinates | 1503386.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C79 H83 P2 |
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Calculated formula | C79 H83 P2 |
Title of publication | Phosphaalkenes in pi-conjugation with acetylenic arenes. |
Authors of publication | Geng, Xue-Li; Hu, Qi; Schäfer, Bernhard; Ott, Sascha |
Journal of publication | Organic letters |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 4 |
Pages of publication | 692 - 695 |
a | 10.095 ± 0.002 Å |
b | 10.465 ± 0.002 Å |
c | 17.655 ± 0.004 Å |
α | 85.03 ± 0.03° |
β | 76.92 ± 0.03° |
γ | 66.43 ± 0.03° |
Cell volume | 1665.2 ± 0.7 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0684 |
Residual factor for significantly intense reflections | 0.0517 |
Weighted residual factors for significantly intense reflections | 0.1281 |
Weighted residual factors for all reflections included in the refinement | 0.1398 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.087 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1503386.cif |
91932 | 2013-12-28 | cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs. |
1503386.cif |
37259 | 2012-03-01 | ../uploads/cif-deposit/cod/cif Adding structures of 1503386 via cif-deposit CGI script. |
1503386.cif |
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Users of the data should acknowledge the original authors of the
structural data.