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Information card for entry 7006466
Preview
| Coordinates | 7006466.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H50 B20 Mo O2 Rh2 S4 |
|---|---|
| Calculated formula | C26 H50 B20 Mo O2 Rh2 S4 |
| SMILES | [Rh]1234567([Mo]89%10%11([Rh]%12%13%14%15%16([S]9[C]9%17%18%19[BH]%20%21%22[BH]%23%249[BH]9%25%17[BH]%17%26%18[BH]%18%27%25[BH]%25%249[BH]9%21%23[BH]%21%23%20[BH]%17%18([BH]%27%259%21)[C]%19%22%26%23[S]%10%12)(C%11=O)[c]9([c]%13([c]%14([c]%15([c]%169C)C)C)C)C)([S]1[C]19%10%11[BH]%12%13%14[BH]%15%161[BH]1%179[BH]9%18%10[BH]%10%19%17[BH]%17%161[BH]1%13%15[BH]%13%15%12[BH]9%10([BH]%19%171%13)[C]%11%14%18%15[S]28)C3=O)[c]1([c]7([c]6([c]5([c]41C)C)C)C)C |
| Title of publication | Heterometallic cluster complexes (RhMo, RhW) containing bridging 1,2-dicarba-closo-dodecaborane-1,2-dichalocogenolato ligands. |
| Authors of publication | Cai, Shuyi; Lin, YueJian; Jin, Guo-Xin |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2006 |
| Journal issue | 7 |
| Pages of publication | 912 - 918 |
| a | 14.062 ± 0.006 Å |
| b | 21.235 ± 0.009 Å |
| c | 15.358 ± 0.007 Å |
| α | 90° |
| β | 109.426 ± 0.008° |
| γ | 90° |
| Cell volume | 4325 ± 3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1768 |
| Residual factor for significantly intense reflections | 0.0684 |
| Weighted residual factors for significantly intense reflections | 0.1283 |
| Weighted residual factors for all reflections included in the refinement | 0.1579 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.8 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179768 (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 7/00/64. |
7006466.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7006466.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7006466.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7006466.cif |
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Users of the data should acknowledge the original authors of the
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