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Information card for entry 2235918
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| Coordinates | 2235918.cif |
|---|---|
| Structure factors | 2235918.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>cis</i>-Diiodido(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-\ tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')palladium(II) |
|---|---|
| Formula | C6 H16 I2 N2 Pd |
| Calculated formula | C6 H16 I2 N2 Pd |
| SMILES | C1[N](C)(C)[Pd](I)(I)[N](C1)(C)C |
| Title of publication | <i>cis</i>-Diiodido(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')palladium(II) |
| Authors of publication | Abellán-López, Antonio; Chicote-Olalla, María Teresa; Bautista-Cerezo, Delia |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 8 |
| Pages of publication | m1129 |
| a | 7.9266 ± 0.0004 Å |
| b | 14.6911 ± 0.0007 Å |
| c | 10.5309 ± 0.0005 Å |
| α | 90° |
| β | 107.262 ± 0.002° |
| γ | 90° |
| Cell volume | 1171.09 ± 0.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.024 |
| Residual factor for significantly intense reflections | 0.0232 |
| Weighted residual factors for significantly intense reflections | 0.0592 |
| Weighted residual factors for all reflections included in the refinement | 0.0597 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.135 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181281 (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 2/23/59. |
2235918.cif 2235918.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. |
2235918.cif 2235918.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2235918.cif 2235918.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. | 2235918.cif 2235918.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2235918.cif 2235918.hkl |
| 65999 | 2012-09-06 | cif/ Adding structures of 2235918 via cif-deposit CGI script. |
2235918.cif |
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Users of the data should acknowledge the original authors of the
structural data.