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Information card for entry 4505529
Preview
| Coordinates | 4505529.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H46 O22 |
|---|---|
| Calculated formula | C23 H39 O22 |
| Title of publication | Molecular Binding and Assembly Behavior of β-Cyclodextrin with Piperazine and 1,4-Dioxane in Aqueous Solution and Solid State |
| Authors of publication | Zhang, Ying-Ming; Yang, Zi-Xin; Chen, Yong; Ding, Fei; Liu, Yu |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2012 |
| Journal volume | 12 |
| Journal issue | 3 |
| Pages of publication | 1370 |
| a | 15.274 ± 0.012 Å |
| b | 10.178 ± 0.008 Å |
| c | 20.961 ± 0.016 Å |
| α | 90° |
| β | 110.251 ± 0.007° |
| γ | 90° |
| Cell volume | 3057 ± 4 Å3 |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.113 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4505529.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4505529.cif |
| 51787 | 2012-04-07 | ../uploads/cif-deposit/cod/cif Adding structures of 4505529 via cif-deposit CGI script. |
4505529.cif |
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Users of the data should acknowledge the original authors of the
structural data.