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Information card for entry 4341247
Preview
| Coordinates | 4341247.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Pyrazolium trans-tetrachlorido-bis(1H-pyrazole)osmate(III) |
|---|---|
| Formula | C9 H13 Cl4 N6 Os |
| Calculated formula | C9 H13 Cl4 N6 Os |
| SMILES | [Os](Cl)(Cl)(Cl)(Cl)([n]1[nH]ccc1)[n]1[nH]ccc1.[nH]1[nH+]ccc1 |
| Title of publication | Osmium(III) Analogues of KP1019: Electrochemical and Chemical Synthesis, Spectroscopic Characterization, X-ray Crystallography, Hydrolytic Stability, and Antiproliferative Activity. |
| Authors of publication | Kuhn, Paul-Steffen; Büchel, Gabriel E; Jovanović, Katarina K; Filipović, Lana; Radulović, Siniša; Rapta, Peter; Arion, Vladimir B. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 20 |
| Pages of publication | 11130 - 11139 |
| a | 7.4126 ± 0.0004 Å |
| b | 12.9016 ± 0.0006 Å |
| c | 16.185 ± 0.0008 Å |
| α | 90° |
| β | 94.6356 ± 0.0017° |
| γ | 90° |
| Cell volume | 1542.78 ± 0.13 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0144 |
| Residual factor for significantly intense reflections | 0.0132 |
| Weighted residual factors for significantly intense reflections | 0.0302 |
| Weighted residual factors for all reflections included in the refinement | 0.0306 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179515 (current) | 2016-03-23 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/12. |
4341247.cif |
| 126912 | 2014-11-12 | cif/ Updating files of 4341247, 4341248, 4341249 Original log message: Adding full bibliography for 4341247--4341249.cif. |
4341247.cif |
| 125090 | 2014-10-08 | cif/ Adding structures of 4341247, 4341248, 4341249 via cif-deposit CGI script. |
4341247.cif |
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