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Information card for entry 4085079
Preview
| Coordinates | 4085079.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H62 F24 Ge2 N2 O8 |
|---|---|
| Calculated formula | C63 H62 F24 Ge2 N2 O8 |
| SMILES | [Ge]12([Ge]34(c5ccc(cc5C(C(F)(F)F)(C(F)(F)F)O3)C)c3ccc(cc3C(O4)(C(F)(F)F)C(F)(F)F)C)(c3ccc(cc3C(O1)(C(F)(F)F)C(F)(F)F)C)c1ccc(cc1C(O2)(C(F)(F)F)C(F)(F)F)C.[N+](C)(C)(C)Cc1ccccc1.C[N+](C)(C)Cc1ccccc1.CC(=O)C.O.O.O |
| Title of publication | Interconversion among Dianionic, Anionic, and Neutral Compounds Bearing a Bond between Two Pentacoordinated Germanium Atoms |
| Authors of publication | Kano, Naokazu; Tsukada, Satoru; Shibata, Yusuke; Kawashima, Takayuki; Sato, Hiroyasu; Guo, Jing-Dong; Nagase, Shigeru |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 1 |
| Pages of publication | 56 |
| a | 19.519 ± 0.017 Å |
| b | 15.046 ± 0.012 Å |
| c | 24.98 ± 0.02 Å |
| α | 90° |
| β | 110.579 ± 0.005° |
| γ | 90° |
| Cell volume | 6868 ± 10 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.063 |
| Residual factor for significantly intense reflections | 0.0502 |
| Weighted residual factors for significantly intense reflections | 0.1111 |
| Weighted residual factors for all reflections included in the refinement | 0.128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.135 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178739 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/50. |
4085079.cif |
| 130789 | 2015-02-04 | cif/ Updating files of 4085079, 4085080, 4085081 Original log message: Adding full bibliography for 4085079--4085081.cif. |
4085079.cif |
| 129240 | 2014-12-30 | cif/ Adding structures of 4085079, 4085080, 4085081 via cif-deposit CGI script. |
4085079.cif |
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