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Information card for entry 7206181
Preview
| Coordinates | 7206181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H30 Br4.25 Cl1.75 N2 |
|---|---|
| Calculated formula | C12 H30 Br4.252 Cl1.748 N2 |
| Title of publication | Solid-state synthesis of mixed trihalides via reversible absorption of dihalogens by non porous onium salts |
| Authors of publication | Meazza, Lorenzo; Martí-Rujas, Javier; Terraneo, Giancarlo; Castiglioni, Chiara; Milani, Alberto; Pilati, Tullio; Metrangolo, Pierangelo; Resnati, Giuseppe |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 13 |
| Pages of publication | 4427 |
| a | 21.8 ± 0.003 Å |
| b | 7.2927 ± 0.001 Å |
| c | 6.8951 ± 0.001 Å |
| α | 90° |
| β | 91.743 ± 0.012° |
| γ | 90° |
| Cell volume | 1095.7 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.0428 |
| Residual factor for significantly intense reflections | 0.0243 |
| Weighted residual factors for significantly intense reflections | 0.0509 |
| Weighted residual factors for all reflections included in the refinement | 0.0563 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180392 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/61. |
7206181.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7206181.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7206181.cif |
| 23568 | 2011-08-09 | ../uploads/cif-deposit/cod/cif Adding structures of 7206177, 7206178, 7206179, 7206180, 7206181 via cif-deposit CGI script. |
7206181.cif |
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