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Structural investigations into a new polymorph of F(4)TCNQ: towards enhanced semiconductor properties
During the course of research into the structure of 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (F(4)TCNQ), C(12)F(4)N(4), an important compound in charge-transfer and organic semiconductor research, a previously unreported polymorph of F(4)TCNQ was grown concomitantly with the known p...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8254529/ https://www.ncbi.nlm.nih.gov/pubmed/34216449 http://dx.doi.org/10.1107/S2053229621006252 |
Sumario: | During the course of research into the structure of 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (F(4)TCNQ), C(12)F(4)N(4), an important compound in charge-transfer and organic semiconductor research, a previously unreported polymorph of F(4)TCNQ was grown concomitantly with the known polymorph from a saturated solution of dichloromethane. The structure was elucidated using single-crystal X-ray diffraction and it was found that the new polymorph packs with molecules in parallel layers, in a similar manner to the layered structure of F(2)TCNQ. The structure was analysed using Hirshfeld surface analysis, fingerprint plots and pairwise interaction energies, and compared to existing data. The structure of a toluene solvate of F(4)TCNQ is also reported. |
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