Information card for entry 8105463
Formula |
C31 H26 Cl2 O6 |
Calculated formula |
C31 H26 Cl2 O6 |
Title of publication |
Crystal structure of 5,17-diformyl-25,26,27,28-tetrahydroxycalix[4]arene- dichloromethane, C31H26Cl2O6 |
Authors of publication |
Wu, Chong; Liu, Xiao-Long; An, Rui; Yang, Ye |
Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication |
2020 |
Journal volume |
235 |
Journal issue |
6 |
Pages of publication |
1349 - 1350 |
a |
11.6965 ± 0.001 Å |
b |
13.8078 ± 0.0011 Å |
c |
16.3257 ± 0.0014 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
2636.6 ± 0.4 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296.15 K |
Number of distinct elements |
4 |
Space group number |
60 |
Hermann-Mauguin space group symbol |
P b c n |
Hall space group symbol |
-P 2n 2ab |
Residual factor for all reflections |
0.1014 |
Residual factor for significantly intense reflections |
0.0765 |
Weighted residual factors for significantly intense reflections |
0.1384 |
Weighted residual factors for all reflections included in the refinement |
0.1487 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.193 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/8105463.html