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Results: 1-11 |
Results: 11
Why doesn't all-trans-1,2,3,4,5,6-hexaspiro(THF)cyclohexane complex metal ions? (vol 65, pg 9182, 2000)
Authors: Rablen, PR Paquette, LA Borden, WT
Citation: Pr. Rablen et al., Why doesn't all-trans-1,2,3,4,5,6-hexaspiro(THF)cyclohexane complex metal ions? (vol 65, pg 9182, 2000), J ORG CHEM, 66(20), 2001, pp. 6838-6838
Ab initio and density functional calculations of F-19 NMR chemical shifts for models of carbonic anhydrase inhibitors
Authors: DerHovanessian, A Rablen, PR Jain, A
Citation: A. Derhovanessian et al., Ab initio and density functional calculations of F-19 NMR chemical shifts for models of carbonic anhydrase inhibitors, J PHYS CH A, 104(25), 2000, pp. 6056-6061
Why doesn't all-trans-1,2,3,4,5,6-hexaspiro(THF)cyclohexane complex metal ions?
Authors: Rablen, PR Paquette, LA Borden, WT
Citation: Pr. Rablen et al., Why doesn't all-trans-1,2,3,4,5,6-hexaspiro(THF)cyclohexane complex metal ions?, J ORG CHEM, 65(26), 2000, pp. 9180-9185
Computational analysis of the solvent effect on the barrier to rotation about the conjugated C-N bond in methyl N,N-dimethylcarbamate
Authors: Rablen, PR
Citation: Pr. Rablen, Computational analysis of the solvent effect on the barrier to rotation about the conjugated C-N bond in methyl N,N-dimethylcarbamate, J ORG CHEM, 65(23), 2000, pp. 7930-7937
Is the acetate anion stabilized by resonance or electrostatics? A systematic structural comparison
Authors: Rablen, PR
Citation: Pr. Rablen, Is the acetate anion stabilized by resonance or electrostatics? A systematic structural comparison, J AM CHEM S, 122(2), 2000, pp. 357-368
Models of F center dot H contacts relevant to the binding of fluoroaromatic inhibitors to carbonic anhydrase II
Authors: DerHovanessian, A Doyon, JB Jain, A Rablen, PR Sapse, AM
Citation: A. Derhovanessian et al., Models of F center dot H contacts relevant to the binding of fluoroaromatic inhibitors to carbonic anhydrase II, ORG LETT, 1(9), 1999, pp. 1359-1362
A comparison of density functional methods for the estimation of proton chemical shifts with chemical accuracy
Authors: Rablen, PR Pearlman, SA Finkbiner, J
Citation: Pr. Rablen et al., A comparison of density functional methods for the estimation of proton chemical shifts with chemical accuracy, J PHYS CH A, 103(36), 1999, pp. 7357-7363
Is hyperconjugation responsible for the "gauche effect" in 1-fluoropropaneand other 2-substituted-1-fluoroethanes?
Authors: Rablen, PR Hoffman, RW Hrovat, DA Borden, WT
Citation: Pr. Rablen et al., Is hyperconjugation responsible for the "gauche effect" in 1-fluoropropaneand other 2-substituted-1-fluoroethanes?, J CHEM S P2, (8), 1999, pp. 1719-1726
Solvent effects on the barrier to C-N bond rotation in N,N-dimethylaminoacrylonitrile
Authors: Rablen, PR Miller, DA Bullock, VR Hutchinson, PH Gorman, JA
Citation: Pr. Rablen et al., Solvent effects on the barrier to C-N bond rotation in N,N-dimethylaminoacrylonitrile, J AM CHEM S, 121(1), 1999, pp. 218-226
Solvent effects on the barrier to C-N bond rotation in N,N-dimethylaminoacrylonitrile: Modeling by reaction field theory and by Monte Carlo simulations
Authors: Rablen, PR Pearlman, SA Miller, DA
Citation: Pr. Rablen et al., Solvent effects on the barrier to C-N bond rotation in N,N-dimethylaminoacrylonitrile: Modeling by reaction field theory and by Monte Carlo simulations, J AM CHEM S, 121(1), 1999, pp. 227-237
C-O and C-S bonds: Stability, bond dissociation energies, and resonance stabilization
Authors: Hadad, CM Rablen, PR Wiberg, KB
Citation: Cm. Hadad et al., C-O and C-S bonds: Stability, bond dissociation energies, and resonance stabilization, J ORG CHEM, 63(24), 1998, pp. 8668-8681
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