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Information card for entry 7102648
Preview
| Coordinates | 7102648.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C238 H224 B3 Cu4 F15 N32 O18 S Zn4 |
|---|---|
| Calculated formula | C238 H200 B3 Cu4 F15 N32 O18 S Zn4 |
| Title of publication | Programmed Single Step Self-assembly of a [2x2] Grid Architecture Built on Metallic Centers of Different Coordination Geometries |
| Authors of publication | Jean-Marie Lehn; Nathalie Kyritsakas; A. Petitjean |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2004 |
| Journal issue | 10 |
| Pages of publication | 1168 - 1169 |
| a | 17.8009 ± 0.0003 Å |
| b | 18.2756 ± 0.0003 Å |
| c | 21.3141 ± 0.0004 Å |
| α | 79.087 ± 0.005° |
| β | 66.993 ± 0.005° |
| γ | 67.425 ± 0.005° |
| Cell volume | 5887.1 ± 0.2 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.243 |
| Residual factor for significantly intense reflections | 0.105 |
| Weighted residual factors for all reflections | 0.661 |
| Weighted residual factors for all reflections included in the refinement | 0.137 |
| Goodness-of-fit parameter for all reflections | 10.909 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.264 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mo-Kα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180128 (current) | 2016-03-26 | cif/7/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/10/26. |
7102648.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7102648.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7102648.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
7102648.cif |
| 903 | 2009-11-23 | cif/ Setting svn:keywords property on those CIFs that did not have them. |
7102648.cif |
| 603 | 2009-03-27 | Adding files from the Chem-Comm-2004/ deposition. |
7102648.cif |
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Users of the data should acknowledge the original authors of the
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