Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2240028
Preview
| Coordinates | 2240028.cif |
|---|---|
| Structure factors | 2240028.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>trans</i>-Difluoridotetrakis-(pyridine-κ<i>N</i>)chromium(III) trichlorido(pyridine-κ<i>N</i>)zincate monohydrate |
|---|---|
| Formula | C25 H27 Cl3 Cr F2 N5 O Zn |
| Calculated formula | C25 H27 Cl3 Cr F2 N5 O Zn |
| Title of publication | Crystal structure of <i>trans</i>-difluoridotetrakis(pyridine-κ<i>N</i>)chromium(III) trichlorido(pyridine-κ<i>N</i>)zincate monohydrate from synchrotron data |
| Authors of publication | Moon, Dohyun; Choi, Jong-Ha |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 11 |
| Pages of publication | 290 - 293 |
| a | 9.135 ± 0.0018 Å |
| b | 12.852 ± 0.003 Å |
| c | 13.607 ± 0.003 Å |
| α | 103.69 ± 0.03° |
| β | 105.07 ± 0.03° |
| γ | 101.25 ± 0.03° |
| Cell volume | 1441.6 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0379 |
| Residual factor for significantly intense reflections | 0.0372 |
| Weighted residual factors for significantly intense reflections | 0.0991 |
| Weighted residual factors for all reflections included in the refinement | 0.0996 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.62998 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181900 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/00 |
2240028.cif 2240028.hkl |
| 181320 | 2016-04-03 | hkl/2/24/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/24/00. |
2240028.cif 2240028.hkl |
| 176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2240028.cif 2240028.hkl |
| 124557 | 2014-10-05 | cif/ hkl/ Adding structures of 2240028 via cif-deposit CGI script. |
2240028.cif 2240028.hkl |
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.