AAAAAA
Results: 26-50/94
Authors:
Fenske, JD
Hasson, AS
Paulson, SE
Kuwata, KT
Ho, A
Houk, KN
Citation: Jd. Fenske et al., The pressure dependence of the OH radical yield from ozone-alkene reactions, J PHYS CH A, 104(33), 2000, pp. 7821-7833
Authors:
Fenske, JD
Kuwata, KT
Houk, KN
Paulson, SE
Citation: Jd. Fenske et al., OH radical yields from the ozone reaction with cycloalkenes, J PHYS CH A, 104(31), 2000, pp. 7246-7254
Authors:
Handschuh, S
Goldfuss, B
Chen, JG
Gasteiger, J
Houk, KN
Citation: S. Handschuh et al., Steroid binding by antibodies and artificial receptors: Exploration of theoretical methods to determine the origins of binding affinities and specificities, J COMPUT A, 14(7), 2000, pp. 611-629
Authors:
Hu, YF
Houk, KN
Citation: Yf. Hu et Kn. Houk, Quantitative predictions of substituent and solvent effects on the regioselectivities of nitrile oxide cycloadditions to electron-deficient alkynes, TETRAHEDRON, 56(42), 2000, pp. 8239-8243
Authors:
Behnam, SM
Behnam, SE
Ando, K
Green, NS
Houk, KN
Citation: Sm. Behnam et al., Stereoelectronic, torsional, and steric effects on rates of enolization ofketones, J ORG CHEM, 65(26), 2000, pp. 8970-8978
Authors:
Nendel, M
Sperling, D
Wiest, O
Houk, KN
Citation: M. Nendel et al., Computational explorations of vinylcyclopropane-cyclopentene rearrangements and competing diradical stereoisomerizations, J ORG CHEM, 65(11), 2000, pp. 3259-3268
Authors:
Goldfuss, B
Steigelmann, M
Khan, SI
Houk, KN
Citation: B. Goldfuss et al., Rationalization of enantioselectivities in dialkylzinc additions to benzaldehyde catalyzed by fenchone derivatives, J ORG CHEM, 65(1), 2000, pp. 77-82
Authors:
Hotta, K
Lange, H
Tantillo, DJ
Houk, KN
Hilvert, D
Wilson, LA
Citation: K. Hotta et al., Catalysis of decarboxylation by a preorganized heterogeneous microenvironment: Crystal structures of abzyme 21D8, J MOL BIOL, 302(5), 2000, pp. 1213-1225
Authors:
Strassner, T
Weitz, A
Rose, J
Wudl, F
Houk, KN
Citation: T. Strassner et al., Toward ferromagnetic materials: prediction of a triplet ground state for heterocyclic polyacenes, CHEM P LETT, 321(5-6), 2000, pp. 459-462
Authors:
Paquette, LA
Reddy, YR
Vayner, G
Houk, KN
Citation: La. Paquette et al., High-rate accelerations in oxy-Cope rearrangements induced by sulfur substitution: Kinetic study involving electronically and geometrically differentiated 1-alkenyl-2-(Z-1-propenyl)-7,7-dimethyl-exo-norbornan-2-ols, J AM CHEM S, 122(44), 2000, pp. 10788-10794
Authors:
Paquette, LA
Reddy, YR
Haeffner, F
Houk, KN
Citation: La. Paquette et al., Consequences of heteroatomic C-6 substitution on rates of the oxyanionic cope rearrangement. The remarkable accelerating effect of sulfide groups, J AM CHEM S, 122(4), 2000, pp. 740-741
Authors:
Qian, WY
Bartberger, MD
Pastor, SJ
Houk, KN
Wilkins, CL
Rubin, Y
Citation: Wy. Qian et al., C-62, a non-classical fullerene incorporating a four-membered ring, J AM CHEM S, 122(34), 2000, pp. 8333-8334
Authors:
Strassner, T
Houk, KN
Citation: T. Strassner et Kn. Houk, Mechanism of permanganate oxidation of alkanes: Hydrogen abstraction and oxygen "rebound", J AM CHEM S, 122(32), 2000, pp. 7821-7822
Authors:
Hrovat, DA
Chen, JG
Houk, KN
Borden, WT
Citation: Da. Hrovat et al., Cooperative and competitive substituent effects on the Cope rearrangementsof phenyl-substituted 1,5-hexadienes elucidated by Becke3LYP/6-31Gcalculations, J AM CHEM S, 122(31), 2000, pp. 7456-7460
Authors:
Tantillo, DJ
Fukuto, JM
Hoffman, BM
Silverman, RB
Houk, KN
Citation: Dj. Tantillo et al., Theoretical studies on N-G-hydroxy-L-arginine and derived radicals: Implications for the mechanism of nitric oxide synthase, J AM CHEM S, 122(3), 2000, pp. 536-537
Attenuating and supplanting nonclassical stabilization: Cr(CO)(3)-complexed benzonorbornenyl cations
Authors:
Tantillo, DJ
Hietbrink, BN
Merlic, CA
Houk, KN
Citation: Dj. Tantillo et al., Attenuating and supplanting nonclassical stabilization: Cr(CO)(3)-complexed benzonorbornenyl cations, J AM CHEM S, 122(29), 2000, pp. 7136-7137
Authors:
Armstrong, A
Washington, I
Houk, KN
Citation: A. Armstrong et al., Transition state stereoelectronics in alkene epoxidations by fluorinated dioxiranes, J AM CHEM S, 122(26), 2000, pp. 6297-6298
Authors:
Wilsey, S
Gonzalez, L
Robb, MA
Houk, KN
Citation: S. Wilsey et al., Ground- and excited-state surfaces for the [2+2]-photocycloaddition of alpha,beta-enones to alkenes, J AM CHEM S, 122(24), 2000, pp. 5866-5876
Authors:
Bartberger, MD
Houk, KN
Powell, SC
Mannion, JD
Lo, KY
Stamler, JS
Toone, EJ
Citation: Md. Bartberger et al., Theory, spectroscopy, and crystallographic analysis of S-nitrosothiols: Conformational distribution dictates spectroscopic behavior, J AM CHEM S, 122(24), 2000, pp. 5889-5890
Authors:
Haeffner, F
Houk, KN
Reddy, YR
Paquette, LA
Citation: F. Haeffner et al., Mechanistic variations and rate effects of alkoxy and thioalkoxy substitutents on anionic oxy-cope rearrangements (vol 121, pg 11880, 1999), J AM CHEM S, 122(15), 2000, pp. 3799-3799
Authors:
Toker, JD
Wentworth, P
Hu, YF
Houk, KN
Janda, KD
Citation: Jd. Toker et al., Antibody-catalysis of a bimolecular asymmetric 1,3-dipolar cycloaddition reaction, J AM CHEM S, 122(13), 2000, pp. 3244-3245
Authors:
Washington, I
Houk, KN
Citation: I. Washington et Kn. Houk, Transition states and origins of stereoselectivity of epoxidations by oxaziridinium salts, J AM CHEM S, 122(12), 2000, pp. 2948-2949
Authors:
Wilsey, S
Houk, KN
Citation: S. Wilsey et Kn. Houk, H/allyl and alkyl/allyl conical intersections: Ubiquitous control elementsin photochemical sigmatropic shifts, J AM CHEM S, 122(11), 2000, pp. 2651-2652
Authors:
Garcia-Garibay, MA
Houk, KN
Keating, AE
Cheer, CJ
Leibovitch, M
Scheffer, JR
Wu, LC
Citation: Ma. Garcia-garibay et al., Computational prediction of the enantioselectivity of a solid-state photoreaction, ORG LETT, 1(8), 1999, pp. 1279-1281
Authors:
Wang, X
Houk, KN
Citation: X. Wang et Kn. Houk, Gating and entropy in guest exchange by Rebek's sportsballs. Theoretical studies of one-door, side-door, and back-door gating, ORG LETT, 1(4), 1999, pp. 591-594