Demaison J - Search Results

1

Semiexperimental equilibrium structures for the equatorial conformers of N-methylpiperidone and tropinone by the mixed estimation method.

Demaison J, Craig NC, Cocinero EJ, Grabow JU, Lesarri A, Rudolph HD. Demaison J, et al. J Phys Chem A. 2012 Aug 30;116(34):8684-92. doi: 10.1021/jp304178n. Epub 2012 Aug 20. J Phys Chem A. 2012. PMID: 22861349

2

Experimental and ab Initio Equilibrium Structure and Harmonic Force Field of 1,2,5-Oxadiazole.

Vázquez J, Demaison J, López-González JJ, Boggs JE, Rudolph HD. Vázquez J, et al. Among authors: demaison j. J Mol Spectrosc. 2001 Jun;207(2):224-237. doi: 10.1006/jmsp.2001.8335. J Mol Spectrosc. 2001. PMID: 11397111

3

The chiral molecule CHClFI: first determination of its molecular parameters by Fourier transform microwave and millimeter-wave spectroscopies supplemented by ab initio calculations.

Cuisset A, Aviles Moreno JR, Huet TR, Petitprez D, Demaison J, Crassous J. Cuisset A, et al. Among authors: demaison j. J Phys Chem A. 2005 Jun 30;109(25):5708-16. doi: 10.1021/jp0443658. J Phys Chem A. 2005. PMID: 16833903

4

The case of the weak N-X bond: Ab initio, semi-experimental, and experimental equilibrium structures of XNO (X = H, F, Cl, OH) and FNO2.

Demaison J, Császár AG, Dehayem-Kamadjeu A. Demaison J, et al. J Phys Chem A. 2006 Dec 21;110(50):13609-17. doi: 10.1021/jp064769v. J Phys Chem A. 2006. PMID: 17165889

5

Equilibrium vs ground-state planarity of the CONH linkage.

Demaison J, Császár AG, Kleiner I, Møllendal H. Demaison J, et al. J Phys Chem A. 2007 Apr 5;111(13):2574-86. doi: 10.1021/jp067278j. Epub 2007 Mar 10. J Phys Chem A. 2007. PMID: 17388342

6

Equilibrium structure of sulfuric acid.

Demaison J, Herman M, Liévin J, Rudolph HD. Demaison J, et al. J Phys Chem A. 2007 Apr 5;111(13):2602-9. doi: 10.1021/jp068808e. Epub 2007 Mar 13. J Phys Chem A. 2007. PMID: 17388349

7

Equilibrium structure and torsional barrier of BH3NH3.

Demaison J, Liévin J, Császár AG, Gutle C. Demaison J, et al. J Phys Chem A. 2008 May 15;112(19):4477-82. doi: 10.1021/jp710630j. Epub 2008 Apr 18. J Phys Chem A. 2008. PMID: 18422295

8

Gas-phase vibrational spectroscopy and ab initio study of organophosphorus compounds: discrimination between species and conformers.

Cuisset A, Mouret G, Pirali O, Roy P, Cazier F, Nouali H, Demaison J. Cuisset A, et al. Among authors: demaison j. J Phys Chem B. 2008 Oct 2;112(39):12516-25. doi: 10.1021/jp804665h. Epub 2008 Sep 9. J Phys Chem B. 2008. PMID: 18781711

9

High-resolution infrared spectroscopy of trans- and cis-H(18)ON(18)O: equilibrium structures of the nitrous acid isomers.

Sironneau V, Orphal J, Demaison J, Chelin P. Sironneau V, et al. Among authors: demaison j. J Phys Chem A. 2008 Oct 23;112(42):10697-702. doi: 10.1021/jp806286p. Epub 2008 Oct 1. J Phys Chem A. 2008. PMID: 18826194

Our study confirms the results of a recent work by Demaison et al. (J. Phys. Chem. A 2006, 110, 13609-13617) concerning the structure of trans-HONO, whereas the new structure of cis-HONO obtained in this paper is a significant improvement compared with the previous …

Our study confirms the results of a recent work by Demaison et al. (J. Phys. Chem. A 2006, 110, 13609-13617) concerning the st …

10

Semiexperimental equilibrium structure for cis,trans-1,4-difluorobutadiene by the mixed estimation method.

Demaison JF, Craig NC. Demaison JF, et al. J Phys Chem A. 2011 Jul 14;115(27):8049-54. doi: 10.1021/jp203575r. Epub 2011 Jun 21. J Phys Chem A. 2011. PMID: 21649437

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