Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2240371
Preview
| Coordinates | 2240371.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Bis(tetramethylammonium) decaaquadi-μ~4~oxido-tetra-μ~3~-oxido-hexadeca-μ~2~-oxido-hexaoxidodimanganesedecavanadate pentahydrate |
|---|---|
| Formula | C8 H54 Mn2 N2 O43 V10 |
| Calculated formula | C8 H48 Mn2 N2 O43 V10 |
| Title of publication | Crystal structures of two decavanadates(V) with pentaaquamanganese(II) pendant groups: (NMe~4~)~2~[V~10~O~28~{Mn(H~2~O)~5~}~2~]·5H~2~O and [NH~3~C(CH~2~OH)~3~]~2~[V~10~O~28~{Mn(H~2~O)~5~}~2~]·2H~2~O |
| Authors of publication | Franco, Maurício P.; Rüdiger, André Luis; Soares, Jaísa F.; Nunes, Giovana G.; Hughes, David L. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 2 |
| Pages of publication | 146 - 150 |
| a | 13.2434 ± 0.0007 Å |
| b | 9.6402 ± 0.0005 Å |
| c | 17.7628 ± 0.0013 Å |
| α | 90° |
| β | 98.626 ± 0.002° |
| γ | 90° |
| Cell volume | 2242.1 ± 0.2 Å3 |
| Cell temperature | 292 ± 2 K |
| Ambient diffraction temperature | 292 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | I 1 2/m 1 |
| Hall space group symbol | -I 2y |
| Residual factor for all reflections | 0.0222 |
| Residual factor for significantly intense reflections | 0.02 |
| Weighted residual factors for significantly intense reflections | 0.0581 |
| Weighted residual factors for all reflections included in the refinement | 0.0597 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 209173 (current) | 2018-07-21 | cif/ Updating space group information in entries 1544721, 1544360, 2240371, 4125252, 4341616, 4341617, 4345475, 4513163, 7056234, 7155391, 7223892, 7229961. |
2240371.cif |
| 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. |
2240371.cif |
| 129521 | 2015-01-11 | cif/ hkl/ Adding structures of 2240371, 2240372 via cif-deposit CGI script. |
2240371.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.