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CIF Information Card
Information card for 2012459
2012458 << 2012459 >> 2012460Preview
|
Coordinates |
2012459.cif |
|
Structure factors |
2012459.hkl |
Structure parameters
| Common name | TCPI-TTF |
| Formula | - C23 H13 N5 S4 - |
| Calculated formula | - C23 H13 N5 S4 - |
| Title of publication | 2-[3-(1-Cyano-2-nitriloethylidene)-2-prop-2-enyl-2,3-dihydro- 1H-isoindol-1-yliden]propanedinitrile:tetrathiafulvalene (1:1), [TCPI/TTF] |
| Authors of publication | Crean, Colm; Gallagher, John F.; Pratt, Albert C. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2002 |
| Journal volume | 58 |
| Pages of publication | o36 - o38 |
| a | 7.3982 ± 0.0011 Å |
| b | 31.854 ± 0.005 Å |
| c | 9.516 ± 0.002 Å |
| α | 90° |
| β | 94.608 ± 0.017° |
| γ | 90° |
| Cell volume | 2235.3 ± 0.7 Å3 |
| Cell temperature | 294 ± 1 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |