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Information card for entry 4313450
Preview
| Coordinates | 4313450.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | ChemSpider |
| Common name | (o-C6F4Hg)3-C16H10 |
|---|---|
| Formula | C34 H10 F12 Hg3 |
| Calculated formula | C34 H10 F12 Hg3 |
| SMILES | [Hg]1c2c([Hg]c3c([Hg]c4c1c(F)c(F)c(F)c4F)c(F)c(F)c(F)c3F)c(F)c(F)c(F)c2F.c1cc2cccc3ccc4c(c23)c1ccc4 |
| Title of publication | Enhancement of the Phosphorescence of Organic Luminophores upon Interaction with a Mercury Trifunctional Lewis Acid |
| Authors of publication | Mohammad A. Omary; Refaie M. Kassab; Mason R. Haneline; O. Elbjeirami; François P. Gabbaï |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2003 |
| Journal volume | 42 |
| Pages of publication | 2176 - 2178 |
| a | 21.908 ± 0.004 Å |
| b | 7.0456 ± 0.0014 Å |
| c | 21.918 ± 0.004 Å |
| α | 90° |
| β | 117.61 ± 0.03° |
| γ | 90° |
| Cell volume | 2997.9 ± 1.3 Å3 |
| Cell temperature | 270 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0679 |
| Residual factor for significantly intense reflections | 0.0572 |
| Weighted residual factors for significantly intense reflections | 0.1396 |
| Weighted residual factors for all reflections included in the refinement | 0.1481 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201982 (current) | 2017-10-13 | cif/ Marking COD entries in range 4 that are known to be related to ChemSpider entries using the _cod_related_entry data loop. |
4313450.cif |
| 179193 | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/34. |
4313450.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4313450.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4313450.cif |
| 17004 | 2011-03-31 | cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif | sort | xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} | > cif_filter --add-cif-header {} | > sponge {} ) 2>&1 | grep NOTE; then svn revert {}; > fi' ) & |
4313450.cif |
| 6519 | 2011-01-11 | ../uploads/cif-deposit/cod/cif Adding structures of 4313450 via cif-deposit CGI script. |
4313450.cif |
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Users of the data should acknowledge the original authors of the
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