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Information card for entry 7052459
Preview
| Coordinates | 7052459.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H24 Cl N2 O7 Re Se |
|---|---|
| Calculated formula | C25 H20 Cl N2 O7 Re Se |
| Title of publication | Synthesis, photophysics, electrochemistry and metal ion-binding studies of rhenium(i) complexes with crown ether pendants: selective and specific binding properties for various metal ions |
| Authors of publication | Wong, Keith Man-Chung; Li, Wei-Ping; Cheung, Kung-Kai; Yam, Vivian Wing-Wah |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2005 |
| Journal volume | 29 |
| Journal issue | 1 |
| Pages of publication | 165 |
| a | 8.669 ± 0.004 Å |
| b | 12.752 ± 0.004 Å |
| c | 13.644 ± 0.004 Å |
| α | 67.57 ± 0.03° |
| β | 89.21 ± 0.03° |
| γ | 72.56 ± 0.03° |
| Cell volume | 1321.4 ± 0.9 Å3 |
| Cell temperature | 301.2 K |
| Ambient diffraction temperature | 301.2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.0264 |
| Weighted residual factors for significantly intense reflections | 0.0319 |
| Goodness-of-fit parameter for significantly intense reflections | 1.496 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKalpha |
| 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. |
7052459.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7052459.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7052459.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' ) & |
7052459.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7052459.cif |
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Users of the data should acknowledge the original authors of the
structural data.