Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7710422
Preview
| Coordinates | 7710422.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H43 Mo12 N6 O52 P |
|---|---|
| Calculated formula | C12 H23 Mo12 N6 O52 P |
| SMILES | [Mo]1234(O[Mo]567([O]89[Mo]%10%11(O[Mo]%12%13%14(O[Mo]%15%16(O[Mo]%17%18%19(O[Mo]%20(=O)([O]%212[Mo]2(O[Mo]%22%23(O[Mo](O5)(O1)([O]%12%22=P9%21[O]%15%18[Mo](=O)(O%17)(O%23)(O2)O%16)(=O)O%14)(O%13)=O)(O%20)(=O)O4)(O[Mo]8(O6)(=O)(O%19)O%11)O3)=O)(O%10)=O)=O)(=O)O7)=O)=O.[NH3+]CC(=O)NCC(=O)[O-].O.[O-]C(=O)CNC(=O)C[NH3+].O.O.O=C(NCC(=O)[O-])C[NH3+] |
| Title of publication | Factors influencing stoichiometry and stability of polyoxometalate - peptide complexes. |
| Authors of publication | Greijer, Björn H; Nestor, Gustav; Eriksson, Jan E.; Seisenbaeva, Gulaim A.; Kessler, Vadim G. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2022 |
| Journal volume | 51 |
| Journal issue | 24 |
| Pages of publication | 9511 - 9521 |
| a | 12.788 ± 0.002 Å |
| b | 31.897 ± 0.005 Å |
| c | 13.843 ± 0.002 Å |
| α | 90° |
| β | 112.173 ± 0.002° |
| γ | 90° |
| Cell volume | 5229 ± 1.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0573 |
| Residual factor for significantly intense reflections | 0.0494 |
| Weighted residual factors for significantly intense reflections | 0.1407 |
| Weighted residual factors for all reflections included in the refinement | 0.1448 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.14 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276619 (current) | 2022-07-06 | cif/ Updating files of 7710422, 7710423, 7710424, 7710425, 7710426, 7710427 Original log message: Adding full bibliography for 7710422--7710427.cif. |
7710422.cif |
| 275890 | 2022-06-08 | cif/ Adding structures of 7710422, 7710423, 7710424, 7710425, 7710426, 7710427 via cif-deposit CGI script. |
7710422.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.