화학공학소재연구정보센터
검색결과 : 12건
No. Article
1 A Computational Study of the Reactivity of 3,5-(Oxo/Thioxo) Derivatives of 2,7-Dimethyl-1,2,4-Triazepines. Keto-Enol Tautomerization and Potential for Hydrogen Storage
Esseffar M, Parish CA, Jala R, Lamsabhi AM
Journal of Physical Chemistry A, 122(11), 3076, 2018
2 Combined Experimental and Theoretical Study on Hydrogen-Bonded Complexes between Cyclic Ketones, Lactones, and Lactams with 3,4-Dinitrophenol
Esseffar M, El Firdoussi A, Bouab W, Abboud JLM, Mo O, Yanez M
Journal of Physical Chemistry A, 113(52), 14711, 2009
3 Density functional theory study of the hydrogen bond interaction between lactones, lactams, and methanol
El Firdoussi A, Esseffar M, Bouab W, Abboud JLM, Mo O, Yanez M, Ruasse MF
Journal of Physical Chemistry A, 109(40), 9141, 2005
4 Push-pull electronic effects in charge-transfer complexes: The case of N-H and N-Me lactams
El Firdoussi A, Esseffar M, Bouab W, Abboud JLM, Mo O, Yanez M
Journal of Physical Chemistry A, 108(47), 10568, 2004
5 Gas-phase basicity of 2,7-dimethyl-[1,2,4]-triazepine thio derivatives
Lamsabhi M, Esseffar M, Bouab W, El Messaoudi T, El Messaoudi M, Abboud JLM, Alcami M, Yanez M
Journal of Physical Chemistry A, 106(32), 7383, 2002
6 Are the thiouracils sulfur bases in the gas-phase?
Lamsabhi M, Alcami M, Mo O, Bouab W, Esseffar M, Abboud JLM, Yanez M
Journal of Physical Chemistry A, 104(21), 5122, 2000
7 An experimental and theoretical study on some thiocarbonyl-I-2 molecular complexes
Esseffar M, Bouab W, Lamsabhi A, Abboud JLM, Notario R, Yanez M
Journal of the American Chemical Society, 122(10), 2300, 2000
8 Protonation of S-4, S-6, and S-8 sulfur cycles. A quantitative study
Abboud JLM, Esseffar M, Herreros M, Mo O, Molina MT, Notario R, Yanez M
Journal of Physical Chemistry A, 102(41), 7996, 1998
9 A New Bond from an Old Molecule - Formation, Stability, and Structure of P4H+
Abboud JL, Herreros M, Notario R, Esseffar M, Mo O, Yanez M
Journal of the American Chemical Society, 118(5), 1126, 1996
10 Is the Depletion of Ozone by Hso an Exothermic Process
Esseffar M, Mo O, Yanez M
Journal of Chemical Physics, 101(3), 2175, 1994