Information card for entry 2013628
Chemical name |
Bis(2,5-dimethoxy-4-methylphenyl)methane |
Formula |
C19 H24 O4 |
Calculated formula |
C19 H24 O4 |
SMILES |
c1(c(cc(c(c1)OC)C)OC)Cc1c(cc(c(c1)OC)C)OC |
Title of publication |
Bis(2,5-dimethoxy-4-methylphenyl)methane and bis(2,5-dimethoxy-3,4,6-trimethylphenyl)methane |
Authors of publication |
Wiedenfeld, David J.; Nesterov, Vladimir N.; Minton, Mark A.; Glass, David R. |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
2003 |
Journal volume |
59 |
Journal issue |
12 |
Pages of publication |
o700 - o702 |
a |
23.282 ± 0.005 Å |
b |
7.728 ± 0.0015 Å |
c |
9.674 ± 0.0019 Å |
α |
90° |
β |
100.1 ± 0.03° |
γ |
90° |
Cell volume |
1713.6 ± 0.6 Å3 |
Cell temperature |
295 ± 2 K |
Ambient diffraction temperature |
295 ± 2 K |
Number of distinct elements |
3 |
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 |
0.088 |
Residual factor for significantly intense reflections |
0.048 |
Weighted residual factors for significantly intense reflections |
0.137 |
Weighted residual factors for all reflections included in the refinement |
0.16 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.089 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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