R. Sebastian

发表

NMR Study of for Benzene and Some Other Fundamental Aromatic Systems Using Alignment of Aromatics in Strong Magnetic Field

R. Laatikainen, J. Ratilainen, R. Sebastian, 1995 .

Some molecular orbital calculations on the conformational behavior of 1,4‐dihydronaphthalene

F. Hruska, T. Schaefer, R. Sebastian, 1992 .

Molecular orbital calculations on anthrone

T. Schaefer, R. Sebastian, 1988 .

1H nuclear magnetic resonance and molecular orbital studies of the structure and internal rotations in ethylbenzene

T. Schaefer, R. Sebastian, G. H. Penner, 1987 .

Molecular orbital computations and 1H nuclear magnetic resonance measurements of the bending motion of xanthene in the gas and in solution

T. Schaefer, R. Sebastian, 1990 .

The benzylic anomeric effect. Internal rotational potentials of ArCH2X compounds (X=F, Cl, SH, SCH3, S(O)CH3, SO2CH3)

T. Schaefer, R. Sebastian, G. H. Penner, 1987 .

Theoretical and experimental approaches to the barrier to rotation about the Csp2—Csp3 bond in benzyl silane. Hyperconjugative stabilization of the perpendicular conformation

T. Schaefer, R. Sebastian, G. H. Penner, 1991 .

Control of the orientation of the aldehyde group in 2-(alkylthio)benzaldehydes by the directional lone-pair on sulfur

T. Schaefer, R. Sebastian, G. H. Penner, 1985 .

Experimental and theoretical assessments of the substituent and medium dependence of the internal rotational potentials in benzyl fluoride. 3,5-Difluorobenzyl fluoride and 4-fluorobenzyl fluoride

F. Hruska, T. Schaefer, R. Sebastian, 1995 .

The conformational dependence of in some 4-fluorophenyl derivatives of methane, ethene, and cyclohexane

J. Peeling, T. Schaefer, R. Sebastian, 1985 .

Characterization of a γ-radiation-induced decomposition product of thymidine. Crystal and molecular structure of the (−)cis(5R,6S) thymidine glycol

J. Cadet, L. Voituriez, A. Grand, 1987 .

Solvent and α-substituent perturbations of the 2H/1H isotope shifts in the 13C nuclear magnetic resonance of toluene-α-d3

J. Peeling, T. Schaefer, R. Sebastian, 1987 .

Concerning lone-pair stereospecificity of intramolecular OH hydrogen bonds to oxygen and sulfur in solution

J. Peeling, T. Schaefer, R. Sebastian, 1987 .

Long-range proton coupling constants and molecular orbital calculations as indicators of conformational populations of benzene-1,2- and -1,3-dicarbaldehydes

T. Schaefer, R. Sebastian, G. H. Penner, 1986 .

2-phenyladamantane as a model for axial phenylcyclohexane. 1H NMR and molecular orbital studies of motion about the Csp2-Csp3 bond

T. Schaefer, R. Sebastian, C. Beaulieu, 1991 .

A theoretical potential for the puckering of dibenzo-p-dioxin

T. Schaefer, R. Sebastian, 1990 .

The proximate coupling constant, 5J(H,CH3), and the torsional mobility of the thiomethyl group in some thioanisole derivatives

J. Baleja, S. Salman, T. Schaefer, 1991 .

Remarks on the barrier to rotation about the Csp2—O bond in anisole

T. Schaefer, R. Sebastian, 1989 .

STO-3G MO calculations on structures and internal rotational barriers of phenol, benzoyl X(X = H, F, CH3, CN, OCH3), acetyl fluoride, acetyl cyanide, and carbonyl cyanide

T. A. Wildman, T. Schaefer, R. Sebastian, 1982 .

Some molecular orbital computations of the internal rotational barrier heights in benzaldehyde and its 4-fluoro, 4-cyano and 4-hydroxy derivatives

F. Hruska, T. Schaefer, R. Sebastian, 1993 .

The signs of 11J(H, CH3) in 2,5-dichlorothioanisole. Couplings as small as 0.03 Hz

S. Salman, T. Schaefer, R. Sebastian, 1982 .

The allyl and benzyl groups as hydrogen bond acceptors in derivatives of 2-allylphenol and 2-benzylphenol

T. A. Wildman, T. Schaefer, R. Sebastian, 1979 .

Long-range 1H, 19F and 13C, 19F coupling constants and molecular orbital computations as indicators of internal motion in C6H5OCF3 and its 4-fluoro derivative

J. Peeling, T. Schaefer, R. Sebastian, 1991 .

Theoretical and experimental data on the internal rotational potential in isopropylbenzene

T. Schaefer, R. Sebastian, G. H. Penner, 1988 .

Some molecular orbital computations of the inversion barrier in 9,10-dihydroanthracene

T. Schaefer, R. Sebastian, 1987 .

Molecular orbital computations of the internal rotational potentials in 2-, 3-, and 4-fluorostyrene. Comparison with experiment

T. Schaefer, R. Sebastian, 1989 .

Molecular orbital and 1H nuclear magnetic resonance studies of the inversion potentials of thianthrene and thioxanthene

T. Schaefer, R. Sebastian, C. Beaulieu, 1991 .

On the existence of intramolecular hydrogen bonds in methyl o-mercaptobenzoate and 2-methoxymethylbenzenethiol

T. Schaefer, R. Sebastian, D. Mckinnon, 1981 .