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1.
2.
Piotr Winiarek Juan Carlos Q. Colmenares Elbieta Fedoryska 《Reaction Kinetics and Catalysis Letters》2004,81(2):333-339
Transformations of diphenylmethane were investigated in a flow system in the presence of alumina and silica-alumina modified
with boron trifluoride at atmospheric pressure and elevated temperatures. Hydrogen transfer reaction was observed on addition
of tetralin to the substrate stream.
This revised version was published online in August 2006 with corrections to the Cover Date. 相似文献
3.
From a 19F-NMR study of 9,11-dicis-12-fluororhodopsin and its photobleached product, we concluded that the initially formed chromophore retained its configuration and the photoproduct corresponded to the two-bond isomerized all-trans. Upon standing, it slowly isomerized to the 9-cis isomer. The method represents a direct, non-destructive procedure for determining configuration purity of the pigment formed. Its unique fluorine opsin shift value is consistent with the expected different orientation of the fluoro-substituent in a dicis pigment. 相似文献
4.
A two‐step reaction scheme leading to singlet carbene species that can be detected under matrix conditions for the reaction of Zr(3F) with either CH3F or CH3CN
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Ana E. Torres Guadalupe Castro Ricardo Pablo‐Pedro Fernando Colmenares 《Journal of computational chemistry》2014,35(11):883-890
The results obtained from CASSCF‐MRMP2 calculations are used to rationalize the singlet complexes detected under matrix‐isolation conditions for the reactions of laser‐ablated Zr(3F) atoms with the CH3F and CH3CN molecules, without invoking intersystem crossings between electronic states with different multiplicities. The reaction Zr(3F) + CH3F evolves to the radical products ZrF· + ·CH3. This radical asymptote is degenerate to that emerging from the singlet channel of the reactants Zr(1D) + CH3F because they both exhibit the same electronic configuration in the metal fragment. Hence, the caged radicals obtained under cryogenic‐matrix conditions can recombine through triplet and singlet paths. The recombination of the radical species along the low‐multiplicity channel produces the inserted structures H3C? Zr? F and H2C?ZrHF experimentally detected. For the Zr(3F) + CH3CN reaction, a similar two‐step reaction scheme involving the radical fragments ZrNC· + ·CH3 explains the presence of the singlet complexes H3C? Zr? NC and H2C?Zr(H)NC revealed in the IR‐matrix spectra upon UV irradiation. © 2014 Wiley Periodicals, Inc. 相似文献
5.
G.K. Surya Prakash Juan C. Colmenares Patrice T. Batamack Thomas Mathew George A. Olah 《Journal of molecular catalysis. A, Chemical》2009,310(1-2):180-183
The hydrolysis of methyl bromide with neutral water is performed in the presence and absence of various amines in a batch reactor at different temperatures (50–125 °C). Screening of poly(4-vinylpyridine) as a potential reusable solid amine catalyst showed maximum efficiency. This significant enhancement in efficiency is due to the capture of HBr by solid PVP and remains phase-separated driving the reaction forward. The major advantage of this process is that the polymer can be easily regenerated and reused without loss of activity making it a very effective catalyst for the conversion of methyl halides to methanol and dimethyl ether. 相似文献
6.
7.
Cinquanta E Ravagnan L Castelli IE Cataldo F Manini N Onida G Milani P 《The Journal of chemical physics》2011,135(19):194501
We perform a systematic investigation of the resonance and vibrational properties of naphthyl-terminated sp carbon chains (dinaphthylpolyynes) by combined multi-wavelength resonant Raman (MWRR) spectroscopy, ultraviolet-visible spectroscopy, and Fourier-transform infrared (FT-IR) spectroscopy, plus ab initio density functional theory (DFT) calculations. We show that the MWWR and FT-IR spectroscopies are particularly suited to identify chains of different lengths and different terminations, respectively. By DFT calculations, we further extend those findings to sp carbon chains end-capped by other organic structures. The present analysis shows that combined MWRR and FT-IR provide a powerful tool to draw a complete picture of chemically stabilized sp carbon chains. 相似文献
8.
Eligio Lisi 《Progress in Particle and Nuclear Physics》2010,64(2):171-177
Established results on neutrino mass, mixing and flavor change (as of 2009) are briefly reviewed. Status and prospects of unknown neutrino properties (smallest mixing angle, Dirac/Majorana nature, absolute masses and their hierarchy) are also discussed. 相似文献
9.
A novel, efficient, and straightforward synthesis of β-N-methylamino-l-alanine (BMAA) in two steps starting from l-N,N-dibenzylserine benzyl ester is described. This method, in the light of other syntheses of BMAA, provides benefits such as mild reaction conditions, a simple work-up procedure, good yields, and the retention of the serine stereochemistry. 相似文献
10.
R. S. H. Liu Erik Krogh Xiao-Yuan Li Dennis Mead L. U. Colmenares J. R. Thiel Jeannette Ellis Darren Wong A. E. Asato 《Photochemistry and photobiology》1993,58(5):701-705
Prompted by the near infrared-absorbing properties of some of the azulenic bacteriorhodopsin (bR) analogs, we have analyzed their absorption characteristics along with 11 new related ring-fused analogs and the corresponding Schiff bases (SB) and protonated Schiff bases (PSB). The following three factors are believed to contribute to the total red shift of each of the pigment analogs (αRS): perturbation of the basic chromophore (SB shift, ΔSB), protonation of the SB (PSB shift, PSBS) and protein perturbation (the opsin shift, OS). For each factor, effects of structural modifications were examined. For the red-shifted pigments, percent OS has been suggested as an alternate way of measuring protein perturbation. Computer-simulated chromophores provided evidence against any explanation involving altered shapes of the binding pocket as a major cause for absorption differences. Implications of the current bR results on preparation of further red-shifted bR and possible application to visual pigment analogs are discussed. 相似文献