Information card for entry 2230236
Chemical name |
2,6-Bis[(4<i>R</i>,5<i>R</i>)-4,5-diphenyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine |
Formula |
C35 H27 N3 O2 |
Calculated formula |
C35 H27 N3 O2 |
SMILES |
c1ccc(cc1)[C@H]1N=C(O[C@@H]1c1ccccc1)c1cccc(n1)C1=N[C@@H]([C@H](O1)c1ccccc1)c1ccccc1 |
Title of publication |
2,6-Bis[(4<i>R</i>,5<i>R</i>)-4,5-diphenyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine |
Authors of publication |
Lin, Ning; Deng, Yan-Qiu; Chen, Miao-Miao; Luo, Ren-Shi; Ng, Seik Weng |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2011 |
Journal volume |
67 |
Journal issue |
6 |
Pages of publication |
o1344 |
a |
19.035 ± 0.002 Å |
b |
6.5908 ± 0.0007 Å |
c |
14.3001 ± 0.0015 Å |
α |
90° |
β |
129.454 ± 0.001° |
γ |
90° |
Cell volume |
1385.2 ± 0.3 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
4 |
Space group number |
5 |
Hermann-Mauguin space group symbol |
C 1 2 1 |
Hall space group symbol |
C 2y |
Residual factor for all reflections |
0.0371 |
Residual factor for significantly intense reflections |
0.0337 |
Weighted residual factors for significantly intense reflections |
0.0952 |
Weighted residual factors for all reflections included in the refinement |
0.0994 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.048 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2230236.html