Self-Consistent Field–Molecular Orbital (SCF–MO) Calculations and Nuclear Magnetic Resonance Measurements for Fosfomycin and Related Compounds

Magnetic Resonance ◽

Molecular Orbital ◽

Mo Calculations ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Related Compounds ◽

Structures of Acrolein−Guanine Adducts: A Semi-Empirical Self-Consistent Field and Nuclear Magnetic Resonance Spectral Study

Chemical Research in Toxicology ◽

10.1021/tx970152g ◽

1998 ◽

Vol 11 (4) ◽

pp. 284-294 ◽

Cited By ~ 9

Author(s):

Donald W. Boerth ◽

Erwin Eder ◽

Sazzad Hussain ◽

Christian Hoffman

Keyword(s):

Magnetic Resonance ◽

Spectral Study ◽

Consistent Field ◽

Self Consistent ◽

Guanine Adducts ◽

Self Consistent Field ◽

Semi Empirical ◽

Multiconfigurational self‐consistent field calculations of nuclear magnetic resonance indirect spin–spin coupling constants

The Journal of Chemical Physics ◽

10.1063/1.468310 ◽

1994 ◽

Vol 101 (8) ◽

pp. 6822-6828 ◽

Cited By ~ 16

Author(s):

Andrzej Barszczewicz ◽

Trygve Helgaker ◽

Michael/ Jaszuński ◽

Poul Jo/rgensen ◽

Kenneth Ruud

Keyword(s):

Magnetic Resonance ◽

Coupling Constants ◽

Spin Coupling ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Spin Coupling Constants ◽

Spin Spin Coupling ◽

Self-Consistent Field Calculation of Nuclear Magnetic Resonance Chemical Shielding Constants Using Gauge-Including Atomic Orbitals and Approximate Two-Electron Integrals

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.7b01006 ◽

2018 ◽

Vol 14 (2) ◽

pp. 619-637 ◽

Cited By ~ 15

Author(s):

Georgi L. Stoychev ◽

Alexander A. Auer ◽

Róbert Izsák ◽

Frank Neese

Keyword(s):

Magnetic Resonance ◽

Field Calculation ◽

Chemical Shielding ◽

Atomic Orbitals ◽

Consistent Field ◽

Self Consistent ◽

Shielding Constants ◽

Self Consistent Field ◽

Inhibitors of sterol biosynthesis. Carbon-13 nuclear magnetic resonance studies of 9 alpha-fluoro-5 alpha-cholest-8(14)-en-3 beta-ol-15-one and related compounds.

The Journal of Lipid Research ◽

10.1016/s0022-2275(20)37311-9 ◽

1981 ◽

Vol 22 (8) ◽

pp. 1188-1197

Author(s):

M Tsuda ◽

G J Schroepfer

Keyword(s):

Magnetic Resonance ◽

Sterol Biosynthesis ◽

Magnetic Resonance Studies ◽

Related Compounds ◽

Carbon-13 Nuclear Magnetic Resonance Spectroscopic Analyses of 3-Aryl-3-hydroxyl-2,2,4,4-tetramethylcyclobutanones and Related Compounds

Journal of the Chinese Chemical Society ◽

10.1002/jccs.200000034 ◽

2000 ◽

Vol 47 (1) ◽

pp. 275-278

Author(s):

Shaw-Tao Lin ◽

Wen-Chung Lin ◽

Yuen-Han Yeh

Keyword(s):

Magnetic Resonance ◽

Spectroscopic Analyses ◽

Related Compounds ◽

ChemInform Abstract: A STUDY OF THE BILE PIGMENTS AND RELATED COMPOUNDS IN SOLUTION BY CARBON-13 NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY

Chemischer Informationsdienst ◽

10.1002/chin.198009347 ◽

1980 ◽

Vol 11 (9) ◽

Author(s):

V. WRAY ◽

A. GOSSAUER ◽

B. GRUENING ◽

G. REIFENSTAHL ◽

H. ZILCH

Keyword(s):

Magnetic Resonance ◽

Magnetic Resonance Spectroscopy ◽

Nuclear Magnetic Resonance Spectroscopy ◽

Resonance Spectroscopy ◽

Bile Pigments ◽

Related Compounds ◽

Pyrroles and related compounds. Part XXXIII. Total synthesis of deuteriated derivatives of protoporphyrin-IX for nuclear magnetic resonance studies of haemoproteins

Journal of the Chemical Society Perkin Transactions 1 ◽

10.1039/p19740001771 ◽

1974 ◽

pp. 1771 ◽

Cited By ~ 50

Author(s):

Jos� A. S. Cavaleiro ◽

Ant�nio M. d'A. Rocha Gonsalves ◽

George W. Kenner ◽

Kevin M. Smith

Keyword(s):

Magnetic Resonance ◽

Total Synthesis ◽

Protoporphyrin Ix ◽

Magnetic Resonance Studies ◽

Derivatives Of ◽

Related Compounds ◽

ChemInform Abstract: NAPHTHALENE TETRACHLORIDES AND RELATED COMPOUNDS. PART 10. THE CARBON-13 NUCLEAR MAGNETIC RESONANCE SPECTRA OF SOME NAPHTHALENE TETRACHLORIDES

Chemischer Informationsdienst ◽

10.1002/chin.198141053 ◽

1981 ◽

Vol 12 (41) ◽

Author(s):

G. A. BOWMAKER ◽

D. CALVERT ◽

P. B. D. DE LA MARE ◽

B. C. J. MCKELLAR

Keyword(s):

Magnetic Resonance ◽

Nuclear Magnetic Resonance Spectra ◽

Related Compounds ◽

Magnetic Resonance Spectra ◽

N-oxides and related compounds. Part XXXI. The nuclear magnetic resonance spectra and tautomerism of some substituted benzofuroxans

Journal of the Chemical Society B Physical Organic ◽

10.1039/j29670000914 ◽

1967 ◽

pp. 914 ◽

Cited By ~ 19

Author(s):

A. J. Boulton ◽

A. R. Katritzky ◽

M. J. Sewell ◽

B. Wallis

Keyword(s):

Magnetic Resonance ◽

Nuclear Magnetic Resonance Spectra ◽

Related Compounds ◽

Magnetic Resonance Spectra ◽

Determination of the conformation of nicotine and some related compounds by nuclear magnetic resonance and dipole moments

Journal of Pharmaceutical Sciences ◽

10.1002/jps.2600560609 ◽

1967 ◽

Vol 56 (6) ◽

pp. 708-713 ◽

Cited By ~ 13

Author(s):

Thomas R. Simpson ◽

J.Cymerman Craig ◽

W.D. Kumler

Keyword(s):

Magnetic Resonance ◽

Dipole Moments ◽

Related Compounds ◽