Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7201968
Preview
| Coordinates | 7201968.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Bis(acetonitrile)-mu-fluoro-mu-tetrafluoroboratechromium(ii) |
|---|---|
| Chemical name | Bis(acetonitrile)-mu-fluoro-mu-tetrafluoroboratechromium(II) |
| Formula | C4 H6 B Cr F5 N2 |
| Calculated formula | C4 H6 B Cr F5 N2 |
| Title of publication | Structure of CrIIF(NCMe)2BF4. Rietveld refinement of a component of a physical mixture of unknown composition |
| Authors of publication | Her, Jae-Hyuk; Stephens, Peter W.; Zhu, Qiuying; Nelson, Kendric J.; Miller, Joel S. |
| Journal of publication | CrystEngComm |
| Year of publication | 2008 |
| Journal volume | 10 |
| Journal issue | 12 |
| Pages of publication | 1728 |
| a | 12.2555 ± 0.0006 Å |
| b | 10.4744 ± 0.0005 Å |
| c | 7.2559 ± 0.0004 Å |
| α | 90° |
| β | 83.019 ± 0.005° |
| γ | 90° |
| Cell volume | 924.53 ± 0.08 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor R(I) for significantly intense reflections | 0.01 |
| Goodness-of-fit parameter for all reflections | 1.141 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.700486 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180350 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/19. |
7201968.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7201968.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7201968.cif |
| 1173 | 2010-05-16 | cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing. | 7201968.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.