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Matrix isolation studies of carbonyl selenide, OCSe: Evidence of the formation of dimeric species, (OCSe)2
(Elsevier Science, 2014-01)
OCSe isolated in solid Ar or N2 at 10 K was investigated by FTIR spectroscopy. The IR spectra of OCSe diluted in a 1:1000 proportion with the matrix gases were interpreted in terms of monomeric carbonyl selenide in a single ...
Structure and photochemical behaviour of 3-azido-acrylophenones: a matrix isolation infrared spectroscopy study
(Pergamon-Elsevier Science Ltd, 2011-10)
(Z)-3-Azido-3-methoxycarbonyl-2-chloro-acrylophenone (MACBP) has been synthesized, isolated in low temperature argon and xenon matrices and studied by FTIR spectroscopy, complemented by DFT(B3LYP)/6-311++G(d,p) calculations. ...
UV-induced photochemistry of matrix-isolated 1-phenyl-4-allyl-tetrazolone
(Royal Society of Chemistry, 2007-12)
The photochemistry and molecular structure of 1-phenyl-4-allyl-tetrazolone (PAT) was studied by FT-IR matrix isolation spectroscopy and DFT(B3LYP)/6-311++G(d,p) calculations. The spectrum of matrix-isolated PAT monomers ...
Experimental and theoretical conformational studies on diallyl sulfide
(Elsevier Science, 2019-04-15)
The conformational properties of diallyl sulfide (DAS), CH 2 [dbnd]CH–CH 2 –S–CH 2 –CH[dbnd]CH 2 , were studied with DFT methods. Eleven structures were found as potential energy minima with the B3LYP/6-31G(d,p) approximation. ...
Conformational and structural analysis of 2-allyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide as probed by matrix-isolation spectroscopy and quantum chemical calculations
(Elsevier Science, 2009-02)
2-Allyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide (ABIOD) has been studied by matrix-isolation infrared spectroscopy and quantum chemical calculations. A conformational search on the B3LYP/6-311++G(3df,3pd) potential energy ...
Gas-phase and matrix-isolation photochemistry of methyl thioglycolate, CH 3 OC(O)CH 2 SH: Influence of the presence of molecular oxygen in the photochemical mechanisms
(Elsevier Science Sa, 2017-07)
The photochemistry of methyl thioglycolate (MTG), CH3OC(O)CH2SH, in gas phase and in matrix isolation conditions was studied by means of FTIR spectroscopy, and the influence of the presence of molecular oxygen on the ...
Matrix Isolation Study of the Conformations and Photochemistry of S‑Ethyl Fluorothioformate, FC(O)SCH2CH3
(American Chemical Society, 2014-11-03)
The IR spectra of S-ethyl fluorothioformate, FC(O)SCH2CH3, were recorded in the vapor phase and compared with the Raman spectrum in the liquid state. Additional IR spectra of the compound isolated in argon and nitrogen ...
Infrared and Raman spectra of [Re(CN)5NO]3- complex isolated in KCl matrix
(Elsevier Science, 2014-11-05)
We report here the infrared and Raman spectra of [Re(CN)5NO]3- complex as guest diluted in the KCl crystal lattice. According to the chemical analysis, the anion concentration in the KCl host matrix is in excess of 2% (in ...
Formation of the matrix-isolated difluoromethylselanes XCF2SeH (X = H, Cl) through photolysis of selenoacetic acids, XCF2C(O)SeH
(Wiley VCH Verlag, 2013-09)
Two hitherto unknown difluoromethylselanes, HCF2SeH and ClCF2SeH, were formed by photolysis of difluoroselenoacetic and chlorodifluoroselenoacetic acids isolated in solid argon. The progress of the photolysis was monitored ...