Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2013322
2013321 << 2013322 >> 2013323Preview
|
Coordinates |
2013322.cif |
Structure parameters
| Common name | 2,4-Dihydroxy-1,3-bis(methoxycarbonylethoxy)calix[4]arene |
| Formula | - C36 H36 O8 - |
| Calculated formula | - C36 H36 O8 - |
| Title of publication | Cone and 1,3-alternate conformers of 1,3-bis(ethoxycarbonylmethoxy)-2,4-dihydroxycalix[4]arene and 1,2,3,4-tetrakis(ethoxycarbonylmethoxy)calix[4]arene |
| Authors of publication | Genorio, Boštjan; Kobe, Jože; Giester, Gerald; Leban, Ivan |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2003 |
| Journal volume | 59 |
| Pages of publication | o221 - o224 |
| a | 10.1364 ± 0.0005 Å |
| b | 10.9403 ± 0.0005 Å |
| c | 27.7309 ± 0.001 Å |
| α | 90° |
| β | 97.917 ± 0.003° |
| γ | 90° |
| Cell volume | 3045.9 ± 0.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 3 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |