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Information card for entry 2234867
Preview
| Coordinates | 2234867.cif |
|---|---|
| Structure factors | 2234867.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis[2-(2-oxoindolin-3-ylidene)-<i>N</i>-phenylhydrazinecarbothioamidato- κ^3^<i>O</i>,<i>N</i>^2^,<i>S</i>]nickel(II) dimethylformamide monosolvate |
|---|---|
| Formula | C33 H29 N9 Ni O3 S2 |
| Calculated formula | C33 H29 N9 Ni O3 S2 |
| Title of publication | Bis[2-(2-oxoindolin-3-ylidene)-<i>N</i>-phenylhydrazinecarbothioamidato-κ^3^<i>O</i>,<i>N</i>^2^,<i>S</i>]nickel(II) dimethylformamide monosolvate |
| Authors of publication | Ali, Amna Qasem; Eltayeb, Naser Eltaher; Teoh, Siang Guan; Salhin, Abdussalam; Fun, Hoong-Kun |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 5 |
| Pages of publication | m538 - m539 |
| a | 12.2491 ± 0.0002 Å |
| b | 12.317 ± 0.0003 Å |
| c | 13.1142 ± 0.0002 Å |
| α | 104.854 ± 0.001° |
| β | 112.943 ± 0.001° |
| γ | 102.798 ± 0.001° |
| Cell volume | 1642.31 ± 0.06 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0583 |
| Residual factor for significantly intense reflections | 0.0406 |
| Weighted residual factors for significantly intense reflections | 0.0972 |
| Weighted residual factors for all reflections included in the refinement | 0.1066 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181270 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/48. |
2234867.cif 2234867.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2234867.cif 2234867.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2234867.cif 2234867.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2234867.cif 2234867.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2234867.cif 2234867.hkl |
| 60373 | 2012-06-14 | cif/ Adding structures of 2234867 via cif-deposit CGI script. |
2234867.cif |
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Users of the data should acknowledge the original authors of the
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