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Information card for entry 4100773
Preview
| Coordinates | 4100773.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C90 H146 Cl6 O8 P8 Pt4 |
|---|---|
| Calculated formula | C90 H146 Cl6 O8 P8 Pt4 |
| SMILES | C1(=O)O[Pt]([P](CC)(CC)CC)([P](CC)(CC)CC)c2cccc3cc4cccc(c4cc23)[Pt](OC(=O)C=CC=CC(=O)O[Pt]([P](CC)(CC)CC)([P](CC)(CC)CC)c2cccc3cc4cccc(c4cc23)[Pt](OC(=O)C=CC=C1)([P](CC)(CC)CC)[P](CC)(CC)CC)([P](CC)(CC)CC)[P](CC)(CC)CC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl |
| Title of publication | Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly |
| Authors of publication | Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2004 |
| Journal volume | 126 |
| Pages of publication | 2464 - 2473 |
| a | 12.293 ± 0.0002 Å |
| b | 13.3346 ± 0.0002 Å |
| c | 18.4568 ± 0.0003 Å |
| α | 83.6936 ± 0.0011° |
| β | 82.6978 ± 0.0009° |
| γ | 63.396 ± 0.001° |
| Cell volume | 2678.43 ± 0.07 Å3 |
| Cell temperature | 150 ± 1 K |
| Ambient diffraction temperature | 150 ± 1 K |
| Number of distinct elements | 6 |
| 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 |
|---|---|---|---|
| 277856 (current) | 2022-09-15 | cif/ Added space group information derived from the space group operation list using the 'cif_filter' program. |
4100773.cif |
| 277855 | 2022-09-15 | cif/ Reordered data items using the 'cif_filter' program to ensure that future changes to the file result in a minimal number of modified lines. |
4100773.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4100773.cif |
| 64641 | 2012-08-21 | cif/4 Completing bibliographic data for a set of JACS-2004 entries |
4100773.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4100773.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. |
4100773.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/' |
4100773.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
4100773.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. |
4100773.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) |
4100773.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.