Interaction of hydronium ion with dibenzo-18-crown-6: NMR, IR, and theoretical study

Journal of Physical Chemistry A

Volumn 112, Issue 41, 2008, Pages 10236-10243

  Kříž, Jaroslav ^a   Dybal, Jiří ^a   Makrlík, Emanuel ^b   Budka, Jan ^c  

^a INSTITUTE OF MACROMOLECULAR CHEMISTRY   (Czech Republic)

^b UNIVERSITY OF WEST BOHEMIA   (Czech Republic)

^c INSTITUTE OF CHEMICAL TECHNOLOGY   (Czech Republic)

Author keywords

[No Author keywords available]

Indexed keywords

ACETONITRILE; COMPLEXATION; CROWN ETHERS; DENSITY FUNCTIONAL THEORY; DICHLOROMETHANE; EQUILIBRIUM CONSTANTS; FLOW INTERACTIONS; FOURIER TRANSFORM INFRARED SPECTROSCOPY; HYDROGEN; HYDROGEN BONDS; NITROBENZENE; NUCLEAR MAGNETIC RESONANCE; OXYGEN; PROBABILITY DENSITY FUNCTION; SULFUR COMPOUNDS;

CORRELATION TIMES; CPMG SEQUENCES; DFT CALCULATIONS; DIPOLAR INTERACTIONS; DYNAMIC EQUILIBRIUMS; FTIR SPECTRUMS; HIGH INTENSITIES; HIGH SYMMETRIES; HYDRONIUM IONS; NORMAL MODES; OXYGEN ATOMS; QUANTUM CHEMICALS; SOLID STATES; STABLE STATES; TRANSVERSE RELAXATIONS; WATER MOLECULES;

NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

CARBON; CATION; CROWN ETHER; DIBENZO 18 CROWN 6; DIBENZO-18-CROWN-6; HYDRONIUM ION; PROTON;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; HYDROGEN BOND; INFRARED SPECTROSCOPY; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM THEORY; STANDARD;

CARBON ISOTOPES; COMPUTER SIMULATION; CROWN ETHERS; HYDROGEN BONDING; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, CHEMICAL; MOLECULAR STRUCTURE; ONIUM COMPOUNDS; PROTONS; QUANTUM THEORY; REFERENCE STANDARDS; SPECTROSCOPY, FOURIER TRANSFORM INFRARED;

EID: 55149117722     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp805757d     Document Type: Article

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