MONONUCLEAR BIS-AMINOCARBYNE COMPLEXES OF TUNGSTEN WITH TP' LIGANDS - THEORY OF METAL-CENTERED CARBYNE-CARBYNE COUPLING

MICROWAVE SPECTROSCOPY OF HYDROQUINONE - THE ROTATIONAL SPECTRUM OF THE CIS CONFORMER

IODINE AZIDE - MOLECULAR-STRUCTURE FROM GAS-PHASE ELECTRON-DIFFRACTION

THE DIMETHYLAMINOETHYL-TETRAMETHYLCYCLOPENTADIENYL LIGAND IN GERMANIUM(II) CHEMISTRY - SYNTHESIS, PROPERTIES AND X-RAY CRYSTAL STRUCTURAL DATA OF (ME(2)NCH(2)CH(2))ME(4)C(5)GECL

Synthesis and hydrogen bonding capabilities of biphenyl-based amino acids designed to nucleate beta-sheet structure

Theoretical study on some nitroresorcinols: Intramolecular hydrogen bonding

Intramolecular interactions in ortho-substituted phenols: survey of DFT-B3LYP calculated data

Visual signalling by asymmetry: a review of perceptual processes

Pd(II) complexes with polydentate nitrogen ligands. Molecular recognition and dynamic behavior involving Pd-N bond rupture. X-ray molecular structures of [{Pd(C6HF4)(2)}(bpzpm)] and [{Pd(eta(3)- C4H7)}(2)(bpzpm)] (CF3SO3)(2) [bpzpm=4, 6-bis(pyrazol-1-yl)pyrimidine]

An ab initio molecular orbital theory and density functional theory study of the conformational free energies of methyltetrahydro-2H-thiopyrans

Characterization of intramolecular hydrogen bonds and competitive chalcogen-chalcogen interactions on the basis of the topology of the charge density

Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part 4. Uracil and thymine

STUDY OF MOLECULAR STRUCTURE OF (CH3)2NSO2CL BY ELECTRON DIFFRACTION SECTOR MICROPHOTOMETER METHOD

RING PUCKERING OF AZETIDINE - ELECTRON-DIFFRACTION STUDY

HEXAMETHYLDISILOXANE AND HEXAMETHYLDISILATHIANE - REACTIONS WITH COVALENT METAL-HALIDES

DIELECTRIC METHODS OF STUDYING THE CHEMICAL-BOND AND THE ELECTRONEGATIVITY CONCEPT

THE METHYLBENZENES .2. FUNDAMENTAL VIBRATIONAL SHIFTS, STATISTICAL THERMODYNAMIC FUNCTIONS, AND PROPERTIES OF FORMATION

IRREDUCIBLE TENSORS OF THE POINT GROUPS WITH FIVEFOLD ROTATIONAL AXES

THE EQUILIBRIUM STRUCTURE OF HIGHLY POLAR MOLECULAR LIQUIDS .1. SO2

MOLECULAR-ORBITAL COMPUTATIONS OF THE INTERNAL ROTATIONAL POTENTIALS IN 2-, 3-, AND 4-FLUOROSTYRENE - COMPARISON WITH EXPERIMENT

FLUORIDES AND FLUORO ACIDS .25. STRUCTURES OF 2 STRONG BRONSTED ACIDS - (I) FLUOROSULFURIC ACID AND (II) TRIFLUOROMETHANESULFONIC ACID

MOLECULAR-STRUCTURE OF 2-FLUOROPHENOL AND 2, 6-DIFLUOROPHENOL FROM GAS-PHASE ELECTRON-DIFFRACTION

PHOSPHORANE IMINATO-TRICHLOROSELENATES(II) - SYNTHESES AND CRYSTAL-STRUCTURES OF [SECL(NPPH3)2]+SECL3-AND [ME3SIN(H)PME3]2+[SE2CL6]2-

CONFORMATIONAL-ANALYSIS OF ALPHA-HELICAL POLYPEPTIDES IN 2 OPPOSITE SCREW FORMS - A COMBINED USE OF H-2 NMR AND MD-SIMULATION

Synthesis and characterization of palladium(II) complexes with new polydentate nitrogen ligands. Dynamic behavior involving Pd-N bond rupture. X-ray molecular structure of [{Pd(eta(3)-C4H7)}(2)(Me-BPzTO)](4-MeC6H4SO3) [Me-BPzTO = 4, 6-bis(4-methylpyrazol-1-yl)-1,3,5-triazin-2-olate]

Ab initio study of the barrier to internal rotation in simple amides - 1. N, N-dimethylformamide and N,N-dimethylcarbamic halogenides

Vibrational spectra of 3, 5-dimethylpyrazole and deuterated derivatives

Spectroscopic and structural consequences of intramolecular hydrogen bond formation in ortho-dimethylaminomethylphenol

Molecular structure and infrared spectra of 4-fluorophenol: A combined theoretical and spectroscopic study

INVESTIGATION OF MOLECULAR STRUCTURE OF SULPHURYL CHLORIDE BY SECTOR MICROPHOTOMETER ELECTRON DIFFRACTION

MEAN AMPLITUDES OF VIBRATION FOR SMALL MOLECULES CONTAINING SULPHUR .I. THIONYL AND SULPHURYL CHLORIDES

FAST GAS-THERMOCHROMATOGRAPHIC SEPARATION OF RADIOACTIVE ELEMENTS .3. PRODUCTION AND THERMOCHROMATOGRAPHIC BEHAVIOR OF VOLATILE OXIDES AND HYDROXIDES OF RADIOACTIVE TUNGSTEN

ELECTRON-DIFFRACTION INVESTIGATION OF MOLECULAR-STRUCTURE OF VINYLSULFONYL CHLORIDE

STRUCTURE AND REACTIVITY OF THE NEAREST ANALOGS OF CARBENES

DETERMINATION OF S-O BOND ORDER IN SULFUR-DIOXIDE AND DIMETHYL SULFITE USING A LOW-ENERGY PARTICLE-ACCELERATOR TECHNIQUE

EVIDENCE FOR THE EXISTENCE OF DIRECTIONAL REPULSION EFFECTS BY LONE VALENCE ELECTRON PAIRS AND PI-BONDS IN TRIGONAL-BIPYRAMIDAL MOLECULES

ANGULAR-CORRELATION AND DIAMAGNETIC SUSCEPTIBILITIES STUDIED BY HIGH-FIELD NMR

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

1, 4-BISHOMO[6]PRISMANE (GARUDANE) - MOLECULAR-STRUCTURE AND STRAIN ANALYSIS OF REACTIONS POTENTIALLY LEADING TO PRISMANES

PREPARATION OF (PERFLUOROALKYL)HALOGENO-1, 3-DISELENETANES FROM THE CORRESPONDING SELENOCARBONYL FLUORIDES AND REACTIONS WITH BORON-TRICHLORIDE OR ARSENIC PENTAFLUORIDE

VIBRATIONAL ANALYSIS OF THE X2A2 STATE OF THE ALLYL RADICAL

CONFORMATIONAL FLEXIBILITY OF DIHYDROPYRIMIDINONE AND TETRAHYDROPYRIMIDINE-2, 4-DIONE RINGS IN DNA BASES

Preparation and NMR spectra of the (trifluoromethyl)argentates(III) [Ag(CF3)(n)X(4-n)](-), with X=CN (n=1-3), CH3, C=CC6H11, Cl, Br (n=2, 3), and I (n=3), and of related silver(III) compounds. Structures of [PPh(4)][trans-Ag(CF3)(2)(CN)(2)] and [PPh(4)][Ag(CF3)(3)(CH3)]

Synthesis of zirconium tetrafluoride molecular complexes with organic ligands from ZrF4 center dot H2O. Crystal structure of [ZrF4(dmso)(2)](2)

Vibrational spectra and structural aspects of fluorosulfites

Ab initio molecular orbital study of energies and conformers of 3, 4-dihydro-1,2-dithiin, 3,6-dihydro-1,2-dithiin, 4H-1,3-dithiin, and 2,3-dihydro-1,4-dithiin

Theoretical and spectroscopic study of gaseous monohydrogenated toluene and 4-methylpyridine

Ab initio and regularized force fields of haloethanes: CH3CH2Cl, CH3CHCl2, CH3CF2Cl, and CH3CFCl2

Gas phase structure of methyl trifluoromethanesulfonate, CH3OSO2CF3, and conformational properties of covalent sulfonates

Ionization energy of o-fluoroaniline and vibrational levels of o-fluoroaniline cation determined by mass-analyzed threshold ionization spectroscopy