11

Ab Initio Static and Molecular Dynamics Study of 4-Styrylpyridine

Latévi M. Lawson Daku, Jorge Linares, Marie-Laure Boillot
Journal:
ChemPhysChem
Year:
2007
Language:
english
File:
PDF, 710 KB
english, 2007
40

Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrixElectronic supplementary information (ESI) available: Table S1 lists the least-squares planes (x, y, z in crystal coordinates) and deviations from them. Figure S1 shows the powder X-ray diffraction patterns recorded at room temperature for the CdPS3 phase, the pre-intercalate with the NMe4+ cation and the intercalated materials 9 and 10. Figures S2 and S3 display the room temperature IR spectra of 9 and 10, which are compared to those of 1 and 5, respectively. Figures S4 and S5 show the EPR spectra of 8 (293 K) and 10 (5 and 291 K). See http://www.rsc.org/suppdata/nj/b3/b311371j/

Floquet, S�bastien, Carmen Mu�oz, M., Rivi�re, Eric, Cl�ment, Ren�, Audi�re, Jean-Paul, Boillot, Marie-Laure
Journal:
New Journal of Chemistry
Year:
2004
Language:
english
File:
PDF, 368 KB
english, 2004