BETA-SULFONYLENAMINES - X-RAY AND H-1 NUCLEAR MAGNETIC-RESONANCE STUDY OF STEREOCHEMISTRY OF ISOMERIC BETA-CHLOROMETHYLSULPHONYL-BETA-METHYL-ALPHA-MORPHOLINOSTYRENES

Fluorocarbonyl trifluoromethanesulfonate, FC(O)OSO2CF3: Structure and conformational properties in the gaseous and condensed phases

ON THE BOND ANGLE IN GECL2 IN THE GROUND AND THE 1ST EXCITED (TRIPLET) STATES - A DENSITY FUNCTIONAL CALCULATION

THE EQUILIBRIUM C-H BOND-LENGTH

Equilibrium structure of sulfuric acid

AN ELECTRON-DIFFRACTION STUDY OF THE STRUCTURE AND VIBRATIONAL CHARACTERISTICS OF THE MOLECULES OF TIN AND LEAD DIHALIDES AND GALLIUM, INDIUM, AND THALLIUM SUBOXIDES

Simple energy minimization for huge Lennard-Jones clusters by dramatic parameter reduction

SYNTHESIS AND STRUCTURE OF A STABLE SILYLENE

Synthesis, X-ray crystallography, and computational analysis of 1-azafenestranes

Estimation of intramolecular hydrogen bond energy via molecular tailoring approach

Candid science: Conversations with famous chemists

EMPIRICAL CORRECTIONS OF SCF GEOMETRIES WITH SPECIAL EXAMPLES FROM 4-21G CALCULATIONS

The rotational spectra, electric dipole moments and molecular structures of anisole and benzaldehyde

THE VIBRATIONAL INFRARED-SPECTRA OF THE TUNGSTEN-OXIDE VAPOR MOLECULE

KINETICS OF CYCLOPROPYL RADICAL REACTIONS .3. STUDY OF SOME 1-SUBSTITUTED CYCLOPROPYL RADICALS BY ELECTRON-PARAMAGNETIC-RES SPECTROSCOPY - THE INVERSION BARRIER FOR 1-METHYCYCLOPROPYL

sigma* resonances in electron transmission (ETS) and x-ray absorption (XAS) spectroscopies of dimethyl(poly)sulphides (CH3)(2)S-x (x = 1, 2, 3)

C-13 NUCLEAR MAGNETIC-RESONANCE SPECTRA .9. STRAIN EFFECTS ON C-13 CHEMICAL-SHIFTS OF TRIAMANTANE

Low-valent gallium, indium, and tin compounds that contain a highly fluorinated tris(pyrazolyl)borate ligand: Syntheses and characterization of [HB(3, 5-(CF3)(2)Pz)(3)]Ga, [HB(3,5- (CF3)(2)Pz)(3)]In, and [HB(3,5-(CF3)(2)Pz)(3)]Sn(CF3SO3)

Techniques in facile calculation of molecular orbital parameters and related conceptualizations - molecular orbital functional groups

Generation of thionitroso compounds from N, N'-thiodiamines. A molecular orbital study

THE DESIGN OF WATER-SOLUBLE BETA-SHEET STRUCTURE BASED ON A NUCLEATION STRATEGY

DIAZADIENE RHODIUM COMPLEXES .3. CONFORMATIONAL STABILITY BY RHODIUM(I)...H-C INTERACTIONS - SOLID-STATE AND SOLUTION STRUCTURE OF [(1, 5-COD)RHCL]2(MU-DAD)

DIAZADIENE COMPLEXES OF GROUP-4 METALS .1. SYNTHESIS OF MONO(DIAZADIENE), BIS(DIAZADIENE) AND TRIS(DIAZADIENE)TITANIUM COMPLEXES AND THE STRUCTURE OF DIAZADIENEDICHLOROTITANIUM

The first coordination complexes of selenones: A structural comparison with complexes of sulfones

AN EMPIRICAL FORCE-FIELD .1. ALKANES

Theoretical study of the changes in the electronic structure of benzonitrile accompanying its conversion into a radical anion

Preparation and crystal structures of a series of titanium(III) 9-BBN hydroborate complexes containing Ti center dot center dot center dot H agostic interactions

INFRARED-SPECTRUM AND NORMAL COORDINATE ANALYSIS OF TUNGSTEN TRIOXIDE

LASER RAMAN-SPECTRA OF TRANSITION-METAL OXIDES AND CATALYSTS

Chemical bonding in hypervalent molecules revised. 2. Application of the atoms in molecules theory to Y(2)XZ and Y(2)XZ(2) (Y = H, F, CH3; X = O, S, Se; Z = O, S) compounds

Planarization of the cyclohexane ring by its incorporation into a cyclophane cage: Hexahydrosuperphane

INVESTIGATION OF ROTATIONAL-ISOMERISM OF PHENYLALKYL SULFIDES

Geminal conjugation in disulfides

MOLECULAR-STRUCTURE AND RING DISTORTIONS OF P-XYLENE AS DETERMINED BY ELECTRON-DIFFRACTION

MOLECULAR-GEOMETRY OF SUBSTITUTED BENZENE-DERIVATIVES .4. ANALYSIS OF VARIANCE IN MONOSUBSTITUTED BENZENE RINGS

GAS CRYSTAL STRUCTURAL DIFFERENCES IN AROMATIC-MOLECULES

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Success and failure of polarized-ion models: Bending and atomization energy of groups 2 and 12 dihalides

Some speculations on the role of excited electronic states in nitrogen-oxygen atmospheric chemistry

THE A1B2-X1A1 2-PHOTON FLUORESCENCE EXCITATION SPECTRUM OF BENZOTRIFLUORIDE

IDEAL-GAS THERMODYNAMIC PROPERTIES OF OXYGEN HETEROCYCLIC-COMPOUNDS .2. 6-MEMBERED, 7-MEMBERED AND 8-MEMBERED RINGS

The molecular geometry of methyl-2-nitrotolyl sulfide determined from joint analysis of the gas electron diffraction data and the results of quantum-mechanical calculations

Molecular structure and conformational composition of 1-[(methylthio)methyl]-2-nitrobenzene (MTMNB): A theoretical and experimental study

STRUCTURE OF TRI-TERT-BUTYLSILANE BY ELECTRON-DIFFRACTION AND MOLECULAR MECHANICS

Stereochemical aspect of the chemistry of hypervalent chalcogen compounds

THE METHYLBENZENES .1. VAPOR-PHASE VIBRATIONAL FUNDAMENTALS, INTERNAL ROTATIONS AND A MODIFIED VALENCE FORCE-FIELD

COMPLEXES OF MOO2CL2 AND WO2CL2 WITH THE LIGANDS N, N,N',N'- TETRAMETHYLETHYLENEDIAMINE, N,N'-DI-T-BUTYL-1,4-DIAZA-1,3-BUTADIENE AND N,N'-DIMETHYLPIPERAZINE - CIS,TRANS,CIS VS ALL CIS COORDINATION IN BIDENTATE N-DONOR COMPLEXES OF WO2CL2 AND MOO2CL2 - CRYSTAL-STRUCTURES OF MOO2CL2(N,N,N',N'-TETRAMETHYLETHYLENEDIAMINE) AND MOO2CL2(N,N'-DI-T-BUTYL-1,4-DIAZA-1,3-BUTADIENE)

POLY(IMINOMETHYLENES) - RIGID ROD HELICAL POLYMERS

Density functional theory study of the interaction between formamide and uracil

Minimum-energy arrangement of three charges on a sphere