Information card for entry 7152364
| Common name |
cone-5 |
| Formula |
C54 H87 N3 O6 |
| Calculated formula |
C54 H87 N3 O6 |
| Title of publication |
Hexahomotrioxacalix[3]arene derivatives as ionophores for molecular recognition of dopamine, serotonin and phenylethylamine. |
| Authors of publication |
Ni, Xin-Long; Rahman, Shofiur; Wang, Shi; Jin, Cheng-Cheng; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko |
| Journal of publication |
Organic & biomolecular chemistry |
| Year of publication |
2012 |
| Journal volume |
10 |
| Journal issue |
23 |
| Pages of publication |
4618 - 4626 |
| a |
11.6724 ± 0.0011 Å |
| b |
14.7955 ± 0.0009 Å |
| c |
16.7566 ± 0.0018 Å |
| α |
97.92 ± 0.007° |
| β |
98.124 ± 0.008° |
| γ |
105.744 ± 0.007° |
| Cell volume |
2709.8 ± 0.4 Å3 |
| Cell temperature |
293 ± 1 K |
| Ambient diffraction temperature |
293 ± 1 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0759 |
| Residual factor for significantly intense reflections |
0.0554 |
| Weighted residual factors for significantly intense reflections |
0.1463 |
| Weighted residual factors for all reflections included in the refinement |
0.1567 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.061 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
Mo-Kα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7152364.html
