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Information card for entry 4060372
Preview
| Coordinates | 4060372.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H62 F12 N2 P2 Ru2 S6 |
|---|---|
| Calculated formula | C36 H62 F12 N2 P2 Ru2 S6 |
| SMILES | C(C)[S]1[Ru]23456([c]7([c]5([c]4([c]3([c]27C)C)C)C)C)[S](CC[S]6CC1)[S]1CC[S]2CC[S](CC)[Ru]345612[c]1([c]6([c]5([c]4([c]31C)C)C)C)C.[P](F)(F)(F)(F)(F)[F-].N#CC.[P](F)(F)(F)(F)(F)[F-].N#CC |
| Authors of publication | Hon Man Lee |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| a | 9.7797 ± 0.0012 Å |
| b | 12.2045 ± 0.0015 Å |
| c | 12.4609 ± 0.0015 Å |
| α | 69.816 ± 0.002° |
| β | 69.704 ± 0.002° |
| γ | 66.951 ± 0.002° |
| Cell volume | 1245.3 ± 0.3 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 130149 (current) | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
4060372.cif |
| 120677 | 2014-07-23 | cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot. |
4060372.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4060372.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. |
4060372.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
4060372.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
4060372.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
4060372.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
4060372.cif |
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Users of the data should acknowledge the original authors of the
structural data.