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Information card for entry 4026593
Preview
Coordinates | 4026593.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H19 N O3 |
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Calculated formula | C27 H19 N O3 |
SMILES | O=N(=O)c1cc2c(c3ccccc3C2=C(c2ccccc2)c2ccc(OC)cc2)cc1 |
Title of publication | Palladium-Catalyzed Annulation of 2-(1-Alkynyl)biphenyls with Aryl Iodides to Disubstituted Methylidenefluorenes. |
Authors of publication | Chin-Chau Chen; Shyh-Chyun Yang; Ming-Jung Wu |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 7631 - 7631 |
a | 11.8911 ± 0.0003 Å |
b | 9.3355 ± 0.0003 Å |
c | 19.5017 ± 0.0007 Å |
α | 90° |
β | 104.559 ± 0.001° |
γ | 90° |
Cell volume | 2095.36 ± 0.11 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1426 |
Residual factor for significantly intense reflections | 0.0669 |
Weighted residual factors for significantly intense reflections | 0.1564 |
Weighted residual factors for all reflections included in the refinement | 0.2017 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 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/4026593.html
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