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Information card for entry 7010611
Preview
| Coordinates | 7010611.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C5.5 H9.5 Cd N3.5 Se2 |
|---|---|
| Calculated formula | C5.5 H9.5 Cd N3.5 Se2 |
| Title of publication | Synthesis and crystal structure of selenocyanato bridged two dimensional supramolecular coordination compounds of cadmium(ii)Electronic supplementary information (ESI) available: Corey–Pauling–Koltun diagram of 2. See http://www.rsc.org/suppdata/dt/b1/b101064f/ |
| Authors of publication | Maji, Tapas Kumar; Sain, Saugata; Mostafa, Golam; Das, Debasis; Lu, Tian-Huey; Chaudhuri, Nirmalendu Ray |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2001 |
| Journal issue | 21 |
| Pages of publication | 3149 |
| a | 8.297 ± 0.001 Å |
| b | 7.9377 ± 0.0009 Å |
| c | 17.184 ± 0.002 Å |
| α | 90° |
| β | 92.396 ± 0.002° |
| γ | 90° |
| Cell volume | 1130.7 ± 0.2 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 c 1 |
| Hall space group symbol | P -2yc |
| Residual factor for all reflections | 0.0529 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1033 |
| Weighted residual factors for all reflections included in the refinement | 0.108 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.972 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7010611.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7010611.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7010611.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7010611.cif |
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Users of the data should acknowledge the original authors of the
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