Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4326380
Preview
| Coordinates | 4326380.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H63 Ge N7 O64 P2 W17 |
|---|---|
| Calculated formula | C15 H45 Ge N6 O64 P2 W17 |
| SMILES | C(CC(=O)O)[Ge]123O[W]456(O[W]789(O[W]%10%11%12(=O)O[W]%13%14%15(=O)O[W]%16%17(=O)(O%10)[O]%11%13=P%10%11[O]7[W]7(O%14)(=O)(O9)O[W]9%13(O%15)(=O)[O]%10[W]%10(O%16)(=O)(O9)O[W]9%14(O%17)(=O)[O]%11[W](O%12)(=O)(O8)(O9)O[W]8(=O)([O]9=P%11%12[O]4[W]4(O7)(=O)(O6)O[W]67(O%13)(=O)[O]%11[W]%11(O%10)(=O)(O6)O[W]9(O%14)(=O)(O8)O[W]6([O]%12[W](O4)(O7)(O2)(O6)=O)(O%11)(O3)=O)(O5)O1)=O)=O.C[NH2+]C.C[NH2+]C.C[NH2+]C.C[NH2+]C.C[NH2+]C.C[NH2+]C.O |
| Title of publication | Synthesis and Structure of Dawson Polyoxometalate-Based, Multifunctional, Inorganic-Organic Hybrid Compounds: Organogermyl Complexes with One Terminal Functional Group and Organosilyl Analogues with Two Terminal Functional Groups |
| Authors of publication | Kenji Nomiya; Yoshihiro Togashi; Yuhki Kasahara; Shotaro Aoki; Hideaki Seki; Marie Noguchi; Shoko Yoshida |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2011 |
| Journal volume | 50 |
| Pages of publication | 9606 - 9619 |
| a | 13.346 ± 0.005 Å |
| b | 13.361 ± 0.005 Å |
| c | 25.664 ± 0.01 Å |
| α | 75.146 ± 0.006° |
| β | 88.619 ± 0.006° |
| γ | 68.397 ± 0.006° |
| Cell volume | 4100 ± 3 Å3 |
| Cell temperature | 90 K |
| Ambient diffraction temperature | 90 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0606 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1306 |
| Weighted residual factors for all reflections included in the refinement | 0.1634 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179366 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/63. |
4326380.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4326380.cif |
| 48544 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 4326380 via cif-deposit CGI script. |
4326380.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.