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Information card for entry 4002173
Preview
| Coordinates | 4002173.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H60 B4 Mg2 O26 |
|---|---|
| Calculated formula | C28 H60 B4 Mg2 O26 |
| Title of publication | Intercalation of Benzoxaborolate Anions in Layered Double Hydroxides: Toward Hybrid Formulations for Benzoxaborole Drugs |
| Authors of publication | Sene, Saad; Bégu, Sylvie; Gervais, Christel; Renaudin, Guillaume; Mesbah, Adel; Smith, Mark E.; Mutin, P. Hubert; van der Lee, Arie; Nedelec, Jean-Marie; Bonhomme, Christian; Laurencin, Danielle |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2015 |
| Journal volume | 27 |
| Journal issue | 4 |
| Pages of publication | 1242 |
| a | 11.233986 ± 0.000014 Å |
| b | 30.92293 ± 0.00004 Å |
| c | 8.6602 ± 0.000013 Å |
| α | 90° |
| β | 135.414 ± 0.00006° |
| γ | 90° |
| Cell volume | 2111.87 ± 0.005 Å3 |
| Cell temperature | 290 K |
| Ambient diffraction temperature | 290 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor R(I) for significantly intense reflections | 5.6949 |
| Goodness-of-fit parameter for all reflections | 1.47 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.999942 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 189197 (current) | 2016-12-18 | cif/4 (antanas@kurmis) Marking attached hydrogens atoms. |
4002173.cif |
| 178377 | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4002173.cif |
| 132774 | 2015-03-04 | cif/ Updating files of 4002171, 4002172, 4002173 Original log message: Adding full bibliography for 4002171--4002173.cif. |
4002173.cif |
| 131581 | 2015-02-08 | cif/4/00/21/ (antanas@koala.ibt.lt) Removing loops '_geom_angle', '_geom_bond', '_geom_contact' since they only contained incorrect values ('no' instead of '?'). |
4002173.cif |
| 131198 | 2015-02-06 | cif/ Adding structures of 4002171, 4002172, 4002173 via cif-deposit CGI script. |
4002173.cif |
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