화학공학소재연구정보센터
검색결과 : 12건
No. Article
1 Multiple Bonding in the Chromium Dimer Supported by Two Diazadiene Ligands
DuPre DB
Journal of Physical Chemistry A, 113(8), 1559, 2009
2 QTAIM Analysis of Ligand Properties and Mechanisms of Tuning of 6-Membered Ring N-Heterocyclic Carbenes in Transition Metal Complexes through Ring-Substituent Variation
Johnson LE, DuPre DB
Journal of Physical Chemistry A, 113(30), 8647, 2009
3 cis- versus trans-Ceramides: Effects of the Double Bond on Conformation and H-Bonding Interactions
Phillips SC, Triola G, Fabrias G, Goni FM, DuPre DB, Yappert MC
Journal of Physical Chemistry B, 113(46), 15249, 2009
4 Topological and orbital-based mechanisms of the electronic stabilization of bis(diisopropylamino)cyclopropenylidene
Johnson LE, DuPre DB
Journal of Physical Chemistry A, 112(32), 7448, 2008
5 Thiamin deprotonation mechanism. Carbanion development stabilized by the LUMOs of thiazolium and pyrimidylimine working in tandem and release governed by a H-bond switch
Dupre DB, Wong JL
Journal of Physical Chemistry A, 111(11), 2172, 2007
6 Mechanism of the electronic stabilization of the 3MR and divalent carbon of bis(diisopropylamino)cyclopropenylidene
Johnson LE, Dupre DB
Journal of Physical Chemistry A, 111(43), 11066, 2007
7 Bonding patterns in a strong 3c2e C-H center dot center dot center dot C hydrogen bond
DuPre DB
Journal of Physical Chemistry A, 109(4), 622, 2005
8 Topological analysis of the electron density in model azolium systems for thiamin structure-function: Sulfur is the electron sink and positively polarized carbanions act as nucleophiles
DuPre DB, Wong JL
Journal of Physical Chemistry A, 109(33), 7606, 2005
9 The compressed hydrogen bond in a molecular proton cage
DuPre DB
Journal of Physical Chemistry A, 107(47), 10142, 2003
10 Cooperative hydrogen- and pi H-bonded interactions involving water and the ethylenic double bond
DuPre DB, Yappert MC
Journal of Physical Chemistry A, 106(3), 567, 2002