An INDO investigation of the stereochemistry and N.M.R. parameters of the pyridinaldehydes

An Extended Hückel Theory. I. Hydrocarbons

1963 • 4,551 citations

Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 Systems

1966 • 1,906 citations

Approximate Self-Consistent Molecular-Orbital Theory. V. Intermediate Neglect of Differential Overlap

1967 • 1,483 citations

Complete determination of the structure of pyridine by microwave spectra

1958 • 232 citations

Self-Consistent Perturbation Theory of Nuclear Spin-Coupling Constants: Application to Couplings Involving Carbon and Fluorine

1971 • 208 citations

Torsional frequencies in the far infrared—V. Torsions around the CC signle bond in some benzaldehydes, furfural, and related compounds

1967 • 191 citations

Approximate self-consistent molecular orbital theory of nuclear spin coupling. I. Directly bonded carbon-hydrogen coupling constants

1970 • 170 citations

(H, H) coupling constants in the nuclear magnetic resonance spectra of hydrocarbon groupings

1962 • 137 citations

Failure of the CNDO/2 method to predict the barriers and conformations in some conjugated systems

1971 • 116 citations

Structural Studies by Nuclear Magnetic Resonance. VI. The Stereospecificity of Coupling between Protons Separated by Five Bonds and Conformations of Some Aromatic Aldehydes

1963 • 107 citations

Carbon-13 nuclear magnetic resonance studies of 2-substituted pyridines

1968 • 59 citations

Quantum mechanical approach to the conformational analysis of macromolecules in ground and excited states

1969 • 53 citations

Carbon-13 nuclear magnetic resonance studies of 4-substituted pyridines

1967 • 48 citations

Nuclear Magnetic Resonance Spectra, Conformations, Spin Coupling Mechanisms, and INDO Molecular Orbital Calculations for the Monofluorobenzaldehydes and some Derivatives

1971 • 48 citations

Carbon-13 nuclear magnetic resonance studies of 3-substituted pyridines

1968 • 34 citations

Molecular Orbital Theory of Diamagnetic Polarization. III. Anisotropic Properties of the Carbonate and Nitrate Ions

1963 • 33 citations

The electrocyclic transformation of cyclopropyl to allyl cation, an all valence SCF MO treatment

1969 • 26 citations

Calculation of the carbon-13 and proton chemical shifts in pyridine

1968 • 26 citations

Proton Magnetic Resonance Spectra, Conformational Preferences, and Approximate Molecular Orbital Calculations for the syn and anti 2-Furanaldoximes

1972 • 20 citations

Molecular polarisability. The conformations of pyridine-2-aldehyde, 2-acetylpyridine, and α-pyridil as solutes in benzene

1966 • 16 citations

Constantes de Couplage en Serie Pyridinique. Application de la Theorie des Orbitales Moleculaires

1971 • 15 citations

Long range coupling constants in monosubstituted methyl and aldehydo pyridines

1970 • 13 citations

Ab Initio versus CNDO barrier calculations

1971 • 10 citations

Deleted Work

1955 • 0 citations