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Information card for entry 8101868
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| Coordinates | 8101868.cif |
|---|
| Chemical name | bis(1-butyl-3-methylimidazolium)hexachlorotitanate(IV) bis(dichloromethane) solvate |
|---|---|
| Formula | C18 H34 Cl10 N4 Ti |
| Calculated formula | C18 H34 Cl10 N4 Ti |
| Title of publication | Crystal structure of bis(1-butyl-3-methylimidazolium) hexachlorotitanate (IV) bis(dichloromethane) solvate, (C~8~H~15~N~2~)~2~[TiCl~6~] · 2CH~2~Cl~2~ |
| Authors of publication | Laus, G.; Bentivoglio, G.; Wurst, K.; Schottenberger, H.; Nauer, G. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2005 |
| Journal volume | 220 |
| Journal issue | 4 |
| Pages of publication | 577 - 578 |
| a | 12.8243 ± 0.0004 Å |
| b | 9.2932 ± 0.0002 Å |
| c | 14.3634 ± 0.0005 Å |
| α | 90° |
| β | 100.572 ± 0.002° |
| γ | 90° |
| Cell volume | 1682.75 ± 0.09 Å3 |
| Cell temperature | 233 ± 2 K |
| Ambient diffraction temperature | 233 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.05 |
| Residual factor for significantly intense reflections | 0.0409 |
| Weighted residual factors for significantly intense reflections | 0.1064 |
| Weighted residual factors for all reflections included in the refinement | 0.1122 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8101868.cif |
| 107934 | 2014-03-24 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8101868.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8101868.cif |
| 12607 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 8101868 via cif-deposit CGI script. |
8101868.cif |
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