Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4315654
Preview
| Coordinates | 4315654.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | B H4 Rb |
|---|---|
| Calculated formula | B H4 Rb |
| SMILES | [BH4-].[Rb+] |
| Title of publication | Cation Size and Anion Anisotropy in Structural Chemistry of Metal Borohydrides. The Peculiar Pressure Evolution of RbBH4 |
| Authors of publication | Yaroslav Filinchuk; Alexandr V. Talyzin; Hans Hagemann; Vladimir Dmitriev; Dmitry Chernyshov; Bertil Sundqvist |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2010 |
| Journal volume | 49 |
| Pages of publication | 5285 - 5292 |
| a | 5.3679 ± 0.0006 Å |
| b | 5.1343 ± 0.0014 Å |
| c | 3.9098 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 107.76 ± 0.03 Å3 |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 3 |
| Space group number | 21 |
| Hermann-Mauguin space group symbol | C 2 2 2 |
| Hall space group symbol | C 2 2 |
| Residual factor R(I) for significantly intense reflections | 5.8354 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.72287 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179236 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/56. |
4315654.cif |
| 120335 | 2014-07-14 | cif/4/31/ (antanas@echidna.ibt.lt) Fixing '_atom_site_type_symbol' tags for COD entries 4315652, 4315653, 4315654, 4315655. |
4315654.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4315654.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4315654.cif |
| 17004 | 2011-03-31 | cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif | sort | xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} | > cif_filter --add-cif-header {} | > sponge {} ) 2>&1 | grep NOTE; then svn revert {}; > fi' ) & |
4315654.cif |
| 8810 | 2011-02-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4315654 via cif-deposit CGI script. |
4315654.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.