Information card for entry 2206373
Common name |
2,3,3',4'-Tetramethylbiphenyl |
Chemical name |
2,3,3',4'-Tetramethylbiphenyl |
Formula |
C16 H18 |
Calculated formula |
C16 H18 |
SMILES |
c1(cccc(c1C)C)c1cc(c(cc1)C)C |
Title of publication |
2,3,3',4'-Tetramethylbiphenyl |
Authors of publication |
Andrew J. Robertson; Daniel J. Price |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2005 |
Journal volume |
61 |
Journal issue |
8 |
Pages of publication |
o2610 - o2612 |
a |
7.6018 ± 0.0005 Å |
b |
7.7685 ± 0.0005 Å |
c |
11.6547 ± 0.0007 Å |
α |
77.106 ± 0.003° |
β |
81.047 ± 0.003° |
γ |
64.506 ± 0.003° |
Cell volume |
604.19 ± 0.07 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
2 |
Space group number |
2 |
Hermann-Mauguin space group symbol |
P -1 |
Hall space group symbol |
-P 1 |
Residual factor for all reflections |
0.0861 |
Residual factor for significantly intense reflections |
0.0489 |
Weighted residual factors for significantly intense reflections |
0.1113 |
Weighted residual factors for all reflections included in the refinement |
0.1266 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.043 |
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/2206373.html