| 6115 - 6121 |
One and two hydrogen molecules in the large cage of the structure II clathrate hydrate: Quantum translation-rotation dynamics close to the cage wall
Sebastianelli F, Xu M, Kanan DK, Bacic Z |
| 6122 - 6126 |
Charge-transfer-induced twisting of the nitro group
Mondal JA, Sarkar M, Samanta A, Ghosh HN, Palit DK |
| 6127 - 6130 |
Interconvertible side-on- and end-on-bonded oxo-superoxo titanium ozonide complexes
Gong Y, Zhou MF, Tian SX, Yang JL |
| 6131 - 6134 |
The investigation of water diffusion into teflon copolymer revealed by fiber-optic evanescent wave spectroscopy
Raichlin Y, Marx S, Katzir A |
| 6135 - 6145 |
Investigation of the influence of solute-solvent interactions on the vibrational energy relaxation dynamics of large molecules in liquids
Pigliucci A, Duvanel G, Daku LML, Vauthey E |
| 6146 - 6150 |
Dynamics of dilute water in carbon tetrachloride
Goodnough JA, Goodrich L, Farrar TC |
| 6151 - 6156 |
Femtosecond time-resolved photophysics of 1,4,5,8-naphthalene diimides
Ganesan P, Baggerman J, Zhang H, Sudholter EJR, Zuilhof H |
| 6157 - 6164 |
Photophysical properties and energy transfer pathway of Er(III) complexes with Pt-porphyrin and terpyridine ligands
Nah MK, Oh JB, Kim HK, Choi KH, Kim YR, Kang JG |
| 6165 - 6175 |
High-resolution microwave studies of ring-structured complexes between trifluoroacetic acid and water
Ouyang B, Starkey TG, Howard BJ |
| 6176 - 6182 |
The nature of ionic liquids in the gas phase
Leal JP, Esperanca JMSS, da Piedade MEM, Lopes JNC, Rebelo LPN, Seddon KR |
| 6183 - 6190 |
Interaction of different metal ions with carboxylic acid group: A quantitative study
Bala T, Prasad BLV, Sastry M, Kahaly MU, Waghmare UV |
| 6191 - 6196 |
High-resolution infrared spectrum of the nu(1) band of eta(5)-C5H5NiNO
Karunatilaka C, Subramanian R, Pedroza D, Idar DJ, Kukolich SG |
| 6197 - 6203 |
Temperature-dependent kinetics study of the gas-phase reactions of OH with n- and i-propyl bromide
Bryukov MG, Vidrine RG, Dellinger B |
| 6204 - 6207 |
Formation and characterization of the tetranuclear scandium nitride: Sc4N4
Gong Y, Zhao YY, Zhou MF |
| 6208 - 6216 |
Theoretical survey of the gas-phase reactions of allylamine with Co+
Ma Y, Guo WY, Zhao LM, Hu SQ, Zhang J, Fu QT, Chen XF |
| 6217 - 6221 |
Imino tautomers of gas-phase guanine from mid-infrared laser spectroscopy
Seefeld K, Brause R, Haber T, Kleinermanns K |
| 6222 - 6224 |
Two-photon absorption dependence on the temperature for azoaromatic compounds: Effect of molecular conformation
De Boni L, Piovesan E, Misoguti L, Zilio SC, Mendonca CR |
| 6225 - 6231 |
Matrix-isolation infrared spectroscopic and theoretical studies on reactions of laser-ablated germanium atoms with water molecules
Teng YL, Jiang L, Han S, Xu Q |
| 6232 - 6240 |
Theoretical study of cycloaddition reactions of heavy carbenes with C-60
Lan CY, Su MD |
| 6241 - 6247 |
Excited state intramolecular proton transfer in schiff bases. Decay of the locally excited enol state observed by femtosecond resolved fluorescence
Rodriguez-Cordoba W, Zugazagoitia JS, Collado-Fregoso E, Peon J |
| 6248 - 6255 |
Spectroscopic properties of MgH2, MgD2, and MgHD calculated from a new ab initio potential energy surface
Li H, Le Roy RJ |
| 6256 - 6262 |
Dynamics of intramolecular hydrogen-atom migrations in 2-hydroxy-3-nitropyridine studied by low-temperature matrix-isolation infrared spectroscopy and density functional theory calculation
Nagaya M, Nakata M |
| 6263 - 6273 |
Interaction of NO2 with hydrocarbon soot: Focus on HONO yield, surface modification, and mechanism
Aubin DG, Abbatt JPD |
| 6274 - 6284 |
Interaction of hydrogen chloride with ice surfaces: The effects of grain size, surface roughness, and surface disorder
McNeill VF, Geiger FM, Loerting T, Trout BL, Molina LT, Molina MJ |
| 6285 - 6295 |
Heterogeneous reactions of linoleic acid and linolenic acid particles with ozone: Reaction pathways and changes in particle mass, hygroscopicity, and morphology
Lee AKY, Chan CK |
| 6296 - 6303 |
Reaction paths of the water-assisted solvolysis of N,N-dimethylformamide
Tsuchida N, Satou H, Yamabe S |
| 6304 - 6315 |
Theoretical analysis of intermolecular covalent pi-pi bonding and magnetic properties of phenalenyl and spiro-biphenalenyl radical pi-dimers
Huang JS, Kertesz M |
| 6316 - 6333 |
Conformational study of (8 alpha,8'beta)-bis(substituted phenyl)-lignano-9,9''-lactones by means of combined computational, database mining, NMR, and chemometric approaches
Kiralj R, Ferreira MMC, Donate PM, da Silva R, Albuquerque S |
| 6334 - 6344 |
Cyanides and isocyanides of first-row transition metals: Molecular structure, bonding, and isomerization barriers
Rayon CM, Redondo P, Valdes H, Barrientos C, Largo A |
| 6345 - 6353 |
Structure and bonding in first-row transition metal dicarbide cations MC2+
Rayon VM, Redondo P, Barrientos C, Largo A |
| 6354 - 6360 |
Ground- and excited-state proton transfer and rotamerism in 2-(2-hydroxyphenyl)-5-phenyl-1,3,4-oxadiazole and its O/"NH or S"-substituted derivatives
Yang ZN, Yang SY, Zhang JP |
| 6361 - 6377 |
Thermochemical properties, Delta H-f degrees(298), S degrees(298), and C-p degrees(T), for n-butyl and n-pentyl hydroperoxides and the alkyl and peroxy radicals, transition states, and kinetics for intramolecular hydrogen shift reactions of the peroxy radicals
Zhu L, Bozzelli JW, Kardos LM |
| 6378 - 6382 |
Structures and static electric properties of novel alkalide anions F-Li+Li- and F-Li3+Li3-
Wang BQ, Li ZR, Wu D, Wang FF |
| 6383 - 6387 |
A combined experimental and theoretical study of uranium polyhydrides with new evidence for the large complex UH4(H-2)(6)
Raab J, Lindh RH, Wang XF, Andrews L, Gagliardi L |
| 6388 - 6396 |
Quantum-chemical study on the effect of lewis acid centers in a poly(ethylene oxide)-based solid electrolyte
Eilmes A, Kubisiak P |
| 6397 - 6405 |
The exceptional hydrogen-bond properties of neutral and protonated lobeline
Locati A, Berthelot M, Evain M, Lebreton J, Le Questel JY, Mathe-Allainmat M, Planchat A, Renault E, Graton J |
| 6406 - 6419 |
Molecular structure, vinyl rotation barrier, and vibrational dynamics of 2,6-dichlorostyrene. A theoretical and experimental research
Ceacero-Vega AA, Ruiz TP, Gomez MF, Roldan JMG, Navarro A, Fernandez-Liencres MP, Jayasooriya UA |
| 6420 - 6424 |
Agostic interaction in the methylidene metal dihydride complexes H2MCH2 (M = Y, Zr, Nb, Mo, Ru, Th, or U)
Roos BO, Lindh R, Cho HG, Andrews L |
| 6425 - 6433 |
Topological properties of the electrostatic potential in weak and moderate N center dot center dot center dot H hydrogen bonds
Mata I, Molins E, Alkorta I, Espinosa E |
| 6434 - 6442 |
Molecular structure and conformational composition of 1,3-dihydroxyacetone studied by combined analysis of gas-phase electron diffraction data, rotational constants, and results of theoretical calculations. Ideal gas thermodynamic properties of 1,3-dihydroxyacetone
Dorofeeva OV, Vogt N, Vogt J, Popik MV, Rykov AN, Vilkov LV |
| 6443 - 6448 |
Can changes in one-bond spin-spin coupling constants in acids be related to gas-phase proton affinities of bases?
Del Bene JE, Elguero J |
| 6449 - 6455 |
Structural study of the thermally induced and photoinduced phase transitions of the 1,3,5-trithia-2,4,6-triazapentalenyl (TTTA) radical
Naumov P, Hill JP, Sakurai K, Tanaka M, Ariga K |
| 6456 - 6467 |
Uncatalyzed transfer hydrogenation of quinones and related systems: A theoretical mechanistic study
Chan B, Radom L |
| 6468 - 6471 |
Rational design and first-principles studies toward the remote substituent effects on a novel tetracyclic proton sponge
Singh A, Ganguly B |
| 6472 - 6480 |
Intramolecular hydrogen bond energy in polyhydroxy systems: A critical comparison of molecular tailoring and isodesmic approaches
Deshmukh MM, Suresh CH, Gadre SR |
| 6481 - 6488 |
Computational study on the mechanisms and energetics of trimethylindium reactions with H2O and H2S
Raghunath P, Lin MC |
| 6489 - 6500 |
A computational investigation of the geometrical structure and protodeboronation of boroglycine, H2N-CH2-B(OH)(2)
Larkin JD, Bhat KL, Markham GD, Brooks BR, Lai JH, Bock CW |
| 6501 - 6509 |
Experimental (C-13 NMR) and theoretical (ab initio molecular orbital calculations) studies on the prototropic tautomerism of benzotriazole and some derivatives symmetrically substituted on the benzene ring
Poznanski J, Najda A, Bretner M, Shugar D |
| 6510 - 6520 |
Thermochemical properties of polycyclic aromatic hydrocarbons (PAH) from G3MP2B3 calculations
Blanquart G, Pitsch H |
| 6521 - 6525 |
Properties of aromaticity indices based on the one-electron density matrix
Cioslowski J, Matito E, Sola M |
| 6526 - 6533 |
SSOH and HSSO radicals: An experimental and theoretical study of [S2OH](0/+/-) species
de Petris G, Rosi M, Troiani A |
| 6534 - 6538 |
A theoretical study of the structure and thermochemical properties of alkali metal fluoroplumbates MPbF3
Boltalin AI, Korenev YM, Sipachev VA |
| 6539 - 6551 |
Structure and stability of small boron and boron oxide clusters
Drummond ML, Meunier V, Sumpter BG |
| 6552 - 6562 |
Pairwise-substitution effects and intramolecular hydrogen bonds in nitrophenols and methylnitrophenols. Thermochemical measurements and ab initio calculations
Heintz A, Kapteina S, Verevkin SP |
| 6563 - 6567 |
pi-donor/acceptor effect on lindqvist type polyoxomolibdates because of various multiple-bonded nitrogenous ligands
Carey DML, Munoz-Castro A, Bustos CJ, Manriquez JM, Arratia-Perez R |
