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Information card for entry 7003555
Preview
| Coordinates | 7003555.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H48 Bi2 N4 O |
|---|---|
| Calculated formula | C36 H48 Bi2 N4 O |
| SMILES | c1(c(cccc1)C[N]1(C)C)[Bi]1(O[Bi]1(c2c(cccc2)C[N]1(C)C)c1c(cccc1)CN(C)C)c1c(cccc1)CN(C)C |
| Title of publication | Hypervalent organobismuth(iii) carbonate, chalcogenides and halides with the pendant arm ligands 2-(Me2NCH2)C6H4 and 2,6-(Me2NCH2)2C6H3 |
| Authors of publication | Breunig, Hans J.; Königsmann, Lucia; Lork, Enno; Nema, Mihai; Philipp, Nicky; Silvestru, Cristian; Soran, Albert; Varga, Richard A.; Wagner, Roxana |
| Journal of publication | Dalton Transactions |
| Year of publication | 2008 |
| Journal issue | 14 |
| Pages of publication | 1831 - 1842 |
| a | 12.812 ± 0.003 Å |
| b | 14.393 ± 0.009 Å |
| c | 19.969 ± 0.004 Å |
| α | 90° |
| β | 98.02° |
| γ | 90° |
| Cell volume | 3646 ± 3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1258 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.0981 |
| Weighted residual factors for all reflections included in the refinement | 0.118 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179739 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/35. |
7003555.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7003555.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7003555.cif |
| 1173 | 2010-05-16 | cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing. | 7003555.cif |
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