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Information card for entry 4340194
Preview
| Coordinates | 4340194.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H54 Cu2 F12 N10 O2 P2 |
|---|---|
| Calculated formula | C30 H54 Cu2 F12 N10 O2 P2 |
| SMILES | O1c2c(n3[n](ccc3)[Cu]341[N](CC[N]3(CC[N]4(C)C)C)(C)C)cc1O[Cu]34([n]5cccn5c1c2)[N](CC[N]3(CC[N]4(C)C)C)(C)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Mono-, di-, and oligonuclear complexes of Cu(II) ions and p-hydroquinone ligands: syntheses, electrochemical properties, and magnetic behavior. |
| Authors of publication | Margraf, Günter; Kretz, Tonia; Fabrizi de Biani, Fabrizia; Laschi, Franco; Losi, Serena; Zanello, Piero; Bats, Jan W.; Wolf, Bernd; Remović-Langer, Katarina; Lang, Michael; Prokofiev, Andrei; Assmus, Wolf; Lerner, Hans-Wolfram; Wagner, Matthias |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2006 |
| Journal volume | 45 |
| Journal issue | 3 |
| Pages of publication | 1277 - 1288 |
| a | 7.6587 ± 0.0008 Å |
| b | 20.46 ± 0.003 Å |
| c | 14.015 ± 0.003 Å |
| α | 90° |
| β | 105.026 ± 0.015° |
| γ | 90° |
| Cell volume | 2121 ± 0.6 Å3 |
| Cell temperature | 156 ± 2 K |
| Ambient diffraction temperature | 156 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0451 |
| Residual factor for significantly intense reflections | 0.0353 |
| Weighted residual factors for significantly intense reflections | 0.0785 |
| Weighted residual factors for all reflections included in the refinement | 0.082 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.192 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179504 (current) | 2016-03-23 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/01. |
4340194.cif |
| 118669 | 2014-06-30 | cif/ Adding structures of 4340194 via cif-deposit CGI script. |
4340194.cif |
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Users of the data should acknowledge the original authors of the
structural data.