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Information card for entry 8102291
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| Coordinates | 8102291.cif |
|---|
| Chemical name | benzyl 2,3-di-O-acetyl-4,6-cyclo-4,6-dideoxy-b-D-galactopyranosyl-(1->4)-2,3,6-tri-O-acetyl-b-D-glucopyranoside |
|---|---|
| Formula | C29 H36 O14 |
| Calculated formula | C29 H36 O14 |
| Title of publication | Crystal structure of benzyl 2,3-di-O-acetyl-4,6-cyclo-4,6-dideoxy-β-D-galactopyranosyl-(1-4)-2,3,6- tri-O-acetyl-β-D-glucopyranoside, C29H36O14 |
| Authors of publication | Wolfgang Frey; Robert Sardzik; Volker Jäger |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2008 |
| Journal volume | 223 |
| Journal issue | 3 |
| Pages of publication | 259 |
| a | 22.475 ± 0.005 Å |
| b | 8.157 ± 0.002 Å |
| c | 18.115 ± 0.003 Å |
| α | 90° |
| β | 97.738 ± 0.015° |
| γ | 90° |
| Cell volume | 3290.8 ± 1.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0816 |
| Residual factor for significantly intense reflections | 0.0589 |
| Weighted residual factors for significantly intense reflections | 0.1526 |
| Weighted residual factors for all reflections included in the refinement | 0.1662 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102291.cif |
| 171772 | 2015-12-31 | cif/ (antanas@kurmis) Removing surrounding qoutes ("'") from the _chemical_name_common tag values in multiple entries. |
8102291.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102291.cif |
| 13030 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102291 via cif-deposit CGI script. |
8102291.cif |
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Users of the data should acknowledge the original authors of the
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