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Information card for entry 4338649
Preview
| Coordinates | 4338649.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H34 Co Hg2 N13 O15 S2 |
|---|---|
| Calculated formula | C38 H34 Co Hg2 N13 O15 S2 |
| SMILES | [Hg]123([n]4ccccc4N4[Co]5678[n]9c(C4=O)cccc9C(=O)N5c4[n]([Hg]5([n]9c(N8C(=O)c8[n]7c(C(=O)N6c6[n]1cccc6)ccc8)cccc9)([O]=S(C)C)([O]=S(C)C)ON(=[O]5)=O)cccc4)([O]=N(=O)O2)[O]=N(=O)O3 |
| Title of publication | Cobalt Complex as Building Blocks: Synthesis, Characterization, and Catalytic Applications of {Cd2±-Co3±-Cd2+} and {Hg2±-Co3±-Hg2+} Heterobimetallic Complexes |
| Authors of publication | Mishra, Anurag; Ali, Afsar; Upreti, Shailesh; Whittingham, M. Stanley; Gupta, Rajeev |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2009 |
| Journal volume | 48 |
| Journal issue | 12 |
| Pages of publication | 5234 - 5243 |
| a | 19.2666 ± 0.0019 Å |
| b | 19.0545 ± 0.0018 Å |
| c | 25.546 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 9378.3 ± 1.7 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0958 |
| Residual factor for significantly intense reflections | 0.0812 |
| Weighted residual factors for significantly intense reflections | 0.1022 |
| Weighted residual factors for all reflections included in the refinement | 0.1081 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 210035 (current) | 2018-08-22 | cif/4/ Updating bibliography in entries 4302333, 4338649. Marking entry 4302333 as a duplicate of entry 4338649. |
4338649.cif |
| 179489 | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/86. |
4338649.cif |
| 114775 | 2014-05-29 | cif/ Adding structures of 4338649, 4338650 via cif-deposit CGI script. |
4338649.cif |
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