Information card for entry 2003172
Formula |
C54 H54 O12 |
Calculated formula |
C54 H54 O12 |
SMILES |
CCOC(=O)COc1c2COCc3cc(cc(c3OCC(=O)OCC)COCc3c(c(COCc1cc(c2)c1ccccc1)cc(c3)c1ccccc1)OCC(=O)OCC)c1ccccc1 |
Title of publication |
7,15,23-Triphenyl-25,26,27-triethylester-2,3,10,11,18,19-hexahomo-3,9,11-trioxacalix[3]arene in a Partial-Cone Conformation |
Authors of publication |
Khrifi, Saad; Guelzim, Abdelhalim; Baert, Francois; Mussrabi, Mamoun; Asfari, Zouhair; Vicens, Jacques |
Journal of publication |
Acta Crystallographica, Section C: Crystal Structure Communications |
Year of publication |
1995 |
Journal volume |
51 |
Journal issue |
1 |
Pages of publication |
153 - 157 |
a |
16.15 ± 0.006 Å |
b |
16.842 ± 0.009 Å |
c |
19.599 ± 0.007 Å |
α |
69.02 ± 0.05° |
β |
80.85 ± 0.04° |
γ |
70.91 ± 0.06° |
Cell volume |
4698 Å3 |
Cell temperature |
293 K |
Number of distinct elements |
3 |
Space group number |
2 |
Hermann-Mauguin space group symbol |
P -1 |
Hall space group symbol |
-P 1 |
Residual factor for significantly intense reflections |
0.059 |
Weighted residual factors for significantly intense reflections |
0.059 |
Diffraction radiation wavelength |
0.71063 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/2003172.html