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Results: 1-10 |
Results: 10
DFT calculations on the protonation of alkanes on HF/SbF5 superacids usingcluster models
Authors: Esteves, PM Ramirez-Solis, A Mota, CJA
Citation: Pm. Esteves et al., DFT calculations on the protonation of alkanes on HF/SbF5 superacids usingcluster models, J PHYS CH B, 105(19), 2001, pp. 4331-4336
A topological study of the transition states of the hydrogen exchange and dehydrogenation reactions of methane on a zeolite cluster
Authors: Okulik, NB Diez, RP Jubert, AH Esteves, PM Mota, CJA
Citation: Nb. Okulik et al., A topological study of the transition states of the hydrogen exchange and dehydrogenation reactions of methane on a zeolite cluster, J PHYS CH A, 105(29), 2001, pp. 7079-7084
Ab initio study of the adamantonium cations: the protonated adamantane
Authors: Esteves, PM Alberto, GGP Ramirez-Solis, A Mota, CJA
Citation: Pm. Esteves et al., Ab initio study of the adamantonium cations: the protonated adamantane, J PHYS CH A, 105(17), 2001, pp. 4308-4311
Iron-exchanged zeolite as effective catalysts for Friedel-Crafts alkylation with alkyl halides
Authors: Bidart, AMF Borges, APS Nogueira, L Lachter, ER Mota, CJA
Citation: Amf. Bidart et al., Iron-exchanged zeolite as effective catalysts for Friedel-Crafts alkylation with alkyl halides, CATAL LETT, 75(3-4), 2001, pp. 155-157
The n-butonium cation (n-C4H11+): The potential energy surface of protonated n-butane
Authors: Esteves, PM Alberto, GGP Ramirez-Solis, A Mota, CJA
Citation: Pm. Esteves et al., The n-butonium cation (n-C4H11+): The potential energy surface of protonated n-butane, J PHYS CH A, 104(26), 2000, pp. 6233-6240
A theoretical study of alkane protonation in HF/SbF5 superacid system
Authors: Esteves, PM Ramirez-Solis, A Mota, CJA
Citation: Pm. Esteves et al., A theoretical study of alkane protonation in HF/SbF5 superacid system, J BRAZ CHEM, 11(4), 2000, pp. 345-348
Reactivity of alkanes on zeolites: A theoretical ab initio study of the H/H exchange
Authors: Esteves, PM Nascimento, MAC Mota, CJA
Citation: Pm. Esteves et al., Reactivity of alkanes on zeolites: A theoretical ab initio study of the H/H exchange, J PHYS CH B, 103(47), 1999, pp. 10417-10420
Ab initio topological analysis of the electronic density in isobutonium cations
Authors: Okulik, N Peruchena, NM Esteves, PM Mota, CJA Jubert, A
Citation: N. Okulik et al., Ab initio topological analysis of the electronic density in isobutonium cations, J PHYS CH A, 103(42), 1999, pp. 8491-8495
Protonation of small alkanes in liquid superacids: Absence of intramolecular C-13 and H-2 scrambling in propane and isobutane
Authors: Goeppert, A Sassi, A Sommer, J Esteves, PM Mota, CJA Karlsson, A Ahlberg, P
Citation: A. Goeppert et al., Protonation of small alkanes in liquid superacids: Absence of intramolecular C-13 and H-2 scrambling in propane and isobutane, J AM CHEM S, 121(45), 1999, pp. 10628-10629
The alkane sigma-bond basicity scale revisited
Authors: Esteves, PM Alberto, GGP Ramirez-Solis, A Mota, CJA
Citation: Pm. Esteves et al., The alkane sigma-bond basicity scale revisited, J AM CHEM S, 121(32), 1999, pp. 7345-7348
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