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Issue DateTitleAuthor(s)TypeAccess
12008Photochemistry of six- and five-membered-ring alpha,beta-unsaturated lactones in cryogenic matricesFausto, Rui ; Breda, Susana ; Kus, Nihal articleopenAccess
27-Sep-2001Conformational isomerism in methyl cyanoacetate: A combined matrix-isolation infrared spectroscopy and molecular orbital studyReva, Igor D. ; Ilieva, Sonia V. ; Fausto, Rui articleopenAccess
31997Molecular structure of S-ethylthioacrylate Combined vibrational spectroscopic and abinitioSCF-MO studyTonge, Peter J. ; Carey, Paul R. ; Fausto, Rui articleopenAccess
415-Apr-2002Low temperature matrix-isolation and solid state vibrational spectra of 5-chlorotetrazoleBugalho, Susana C. S. ; Serra, A. C. ; Lapinski, Leszek ; Cristiano, M. Lurdes S. ; Fausto, Rui articleopenAccess
52006Segredos da luz e da matéria.Fiolhais, Carlos ; Martins, Décio ; Fernandes, João ; Miguel, Maria da Graça ; Mota, Paulo Gama ; Fausto, Rui bookPartopenAccess
630-Mar-2006Conformational Study of Monomeric 2,3-Butanediols by Matrix-Isolation Infrared Spectroscopy and DFT CalculationsJesus, A. J. Lopes ; Rosado, Mário T. S. ; Reva, Igor ; Fausto, Rui ; Eusébio, M. Ermelinda ; Redinha, J. S. articleopenAccess
72008Selective IR-induced isomerization of 1,2-dichloropropane isolated in xenon matrixOlbert-Majkut, Adriana ; Reva, Igor D. ; Fausto, Rui articleopenAccess
81999Structure elucidation and photochemistry of substituted carboxylic compounds by low temperature matrix-isolation and solid state vibrational spectroscopyFausto, Rui ; Maçôas, Ermelinda M. S. ; Kulbida, A. articleopenAccess
91998Molecular structure and vibrational spectra of methyl cyanoacetate: an FT-IR, raman and ab initio molecular orbital studyNeta, João Miguel F. ; Fausto, Rui articleopenAccess
1010-May-2021Structural Relevance of Intramolecular H-Bonding in Ortho-Hydroxyaryl Schiff Bases: The Case of 3-(5-bromo-2-hydroxybenzylideneamino) PhenolSıdır, İsa; Gülseven Sıdır, Yadigar; Góbi, Sándor ; Berber, Halil; Fausto, Rui articleopenAccess
1122-May-2008Structure of Isolated 1,4-Butanediol: Combination of MP2 Calculations, NBO Analysis, and Matrix-Isolation Infrared SpectroscopyJesus, A. J. Lopes ; Rosado, Mário T. S. ; Reva, Igor ; Fausto, Rui ; Eusébio, M. Ermelinda S. ; Redinha, J. S. articleopenAccess
1220-Feb-1995An electronic and vibrational study of the cyclopropenyl ion and its fluoroderivativesGalembeck, Sérgio E. ; Fausto, Rui articleopenAccess
13Mar-1998Vibrational spectra of acid and alkaline glycine saltsRosado, Mário T ; Duarte, Maria Leonor T. S. ; Fausto, Rui articleopenAccess
1416-Jun-1997Vibrational spectra (FT-IR, Raman and MI-IR) of α- and β-alanineRosado, Mário Túlio S. ; Duarte, Maria Leonor R. S. ; Fausto, Rui articleopenAccess
152-Nov-2002Vibrational spectra and structure of 1-phenyltetrazole and 5-chloro-1-phenyltetrazole: A combined study by low temperature matrix isolation and solid state FTIR spectroscopy and DFT calculationsBugalho, Susana C. S. ; Lapinski, Leszek ; Cristiano, M. Lurdes S. ; Frija, Luís M. T. ; Fausto, Rui articleopenAccess
167-Jun-2002Matrix isolation FTIR and molecular orbital study of E and Z acetaldoxime monomersAndrzejewska, Agnieszka ; Lapinski, Leszek ; Reva, Igor ; Fausto, Rui articleopenAccess
17Apr-2002Thermal study of simple amino-alcohol solutionsBaudot, Anne ; Cacela, Constança ; Duarte, Maria Leonor ; Fausto, Rui articleopenAccess
182005Photochemical alpha-Cleavage in Pyran-2-thione: Generation of Aldehyde-Thioketene and Thioaldehyde-Ketene PhotoproductsBreda, Susana ; Reva, Igor D. ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
192006Conformational cooling and conformation selective aggregation in dimethyl sulfite isolated in solid rare gasesBorba, Ana ; Gómez-Zavaglia, Andrea ; Fausto, Rui articleopenAccess
201999A concerted SCF-MO ab initio and vibrational spectroscopic study of the conformational isomerism in 2-aminoethanolSilva, Constança F. P. ; Duarte, Maria Leonor T. S. ; Fausto, Rui articleopenAccess
21Dec-2014Intermolecularly-induced conformational disorder in ferrocene, 1-bromoferrocene and 1,1′-dibromoferroceneSilva, Patrícia A. ; Maria, Teresa M. R. ; Nunes, Cláudio M. ; Eusébio, Maria Ermelinda S. ; Fausto, Rui articleopenAccess
2214-Nov-2002Molecular structure and infrared spectra of dimethyl malonate: A combined quantum chemical and matrix-isolation spectroscopic studyLopes, Susy ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
2319-Sep-2003Photoisomerization reactions of 4-methoxy- and 4-hydroxy-6-methyl-α-pyrones: An experimental matrix isolation and theoretical density functional theory studyBreda, Susana ; Lapinski, Leszek ; Fausto, Rui ; Nowak, Maciej J. articleopenAccess
241999A molecular orbital study on the conformational properties of dopamine [1,2-benzenediol-4(2-aminoethyl)]and dopamine cationFausto, Rui ; Ribeiro, Maria João S. ; Lima, João J. Pedroso de articleopenAccess
2515-Jan-2001The low temperature crystalline and glassy states of methyl -hydroxy-isobutyrateJarmelo, Susana ; Maria, Teresa M. R. ; Leitão, Maria Luísa P. ; Fausto, Rui articleopenAccess
262000Structural and vibrational characterisation of 3-amino-1-propanol a concerted SCF-MO ab initio, Raman and infrared (matrix isolation and liquid phase) spectroscopy studyCacela, Constança ; Duarte, M. L. ; Fausto, Rui articleopenAccess
2729-Jul-2003Conformational Behavior of Cyanoacetic Acid:  A Combined Matrix Isolation Fourier Transform Infrared Spectroscopy and Theoretical StudyReva, Igor D. ; Stepanian, Stepan G. ; Adamowicz, Ludwik ; Fausto, Rui articleopenAccess
28Dec-2001Vibrational spectroscopy and ab initio MO study of the molecular structure and vibrational spectra of α- and γ-pyronesFausto, Rui ; Quinteiro, Graciete ; Breda, Susana articleopenAccess
291993Conformers, Vibrational Spectra and Laser-induced RotamerizationFausto, Rui ; Teixeira-Dias, José J. C. ; Gil, Francisco P. S. C. articleopenAccess
307-Aug-1998Diels−Alder Reactions of Acyclic 2-Azadienes: A Semiempirical Molecular Orbital StudyMelo, Teresa M. V. D. Pinho e ; Fausto, Rui ; Gonsalves, António M. d'A. Rocha articleopenAccess
3120-Oct-2006Stepwise conformational cooling towards a single isomeric state in the four internal rotors system 1,2-butanediolReva, Igor D. ; Jesus, António J. Lopes ; Rosado, Mário T. S. ; Fausto, Rui ; Eusébio, M. Ermelinda ; Redinha, J. S. articleopenAccess
3226-Mar-2002Structure and vibrational spectra of -hydroxy isobutyric acid in the crystalline and glassy phases and isolated in inert gas matrixesJarmelo, Susana ; Fausto, Rui articleopenAccess
3319-Jul-2001Low temperature matrix-isolation and solid state vibrational spectra of tetrazoleBugalho, Susana C. S. ; Maçôas, Ermelinda M. S. ; Cristiano, M. Lurdes S. ; Fausto, Rui articleopenAccess
3415-Jul-2002Molecular structure and infrared spectra of dimethyl fumarateLopes, Susy ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
359-Apr-2003Conformational Isomerization of Formic Acid by Vibrational Excitation at Energies below the Torsional BarrierPettersson, Mika ; Maçôas, Ermelinda M. S. ; Khriachtchev, Leonid ; Fausto, Rui ; Räsänen, Markku articleopenAccess
362006Intermolecular cycloaddition of nonstabilized azomethine ylides generated from 1,3-thiazolidine-4-carboxylic acids: synthesis of 5,7a-dihydro-1H,3H-pyrrolo[1,2-c]thiazolesCardoso, Ana L. ; Kaczor, Agnieszka ; Silva, Artur M. S. ; Fausto, Rui ; Melo, Teresa M. V. D. Pinho e ; Gonsalves, António M. d'A. Rocha articleopenAccess
3720094-Halo-1,3-oxazoles: Unambiguous structural assignment of 2-halo-2-benzoyl-2H-azirine-3-carboxylates thermal ring expansion productsLopes, Susy ; Nunes, Cláudio M. ; Fausto, Rui ; Melo, Teresa M. V. D. Pinho e articleopenAccess
38Sep-2007[Erratum] FTIR Spectroscopic and Theoretical Study of the Photochemistry of Matrix-isolated CoumarinKus, Nihal ; Breda, Susana ; Reva, Igor ; Tasal, Erol ; Ogretir, Cemil ; Fausto, Rui articleopenAccess
39Feb-2008Photoinduced transformation of matrix-isolated methyl 2-pyrone-3-carboxylate into methyl 2-pyrone-5-carboxylate via intramolecular hydrogen shift in open-ring aldehyde–keteneReva, Igor ; Nowak, Maciej J. ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
402009Low Temperature Infrared Spectroscopy Study of Pyrazinamide: From the Isolated Monomer to the Stable Low Temperature Crystalline PhaseBorba, Ana ; Albrecht, Merwe ; Gómez-Zavaglia, Andrea ; Suhm, Martin A. ; Fausto, Rui articleopenAccess
41Jul-2008Low temperature IR spectroscopy and photochemistry of matrix-isolated α-pyridilLopes, Susy ; Gómez-Zavaglia, Andrea ; Fausto, Rui articleopenAccess
4230-Oct-2007Dissociation of ground and nσ* states of CF3Cl using multireference configuration interaction with singles and doubles and with multireference average quadratic coupled cluster extensivity correctionsLucena Jr, Juracy R. ; Ventura, Elizete ; Monte, Silmar A. do ; Araújo, Regiane C. M. U. ; Ramos, Mozart N. ; Fausto, Rui articleopenAccess
43Nov-2006Hexahydro-Pyrrolo[1',2',5':3,4,5]Thiazolo[3,4-c]Oxazol-1-ones: New Chiral Tricyclic L-Cysteine and D-Penicillamine Derivatives.Melo, Teresa M. V. D. Pinho e ; Lopes, Susana M. M. ; Gonsalves, Antonio M. d'A Rocha ; Kaczor, Agnieszka ; Fausto, Rui ; Paixão, José A. ; Beja, Ana Matos ; Silva, Manuela Ramos articleopenAccess
442007Substituent effects on the photolysis of methyl 2-carboxylate substituted aliphatic 2H-azirinesGómez-Zavaglia, Andrea ; Kaczor, Agnieszka ; Cardoso, Ana L. ; Melo, Teresa M. V. D. Pinho e ; Fausto, Rui articleopenAccess
451996An Infrared and Raman Spectroscopic Study of Crystalline Trans-Crotonic AcidFausto, Rui articleopenAccess
462000Structural and vibrational characterization of methyl glycolate in the low temperature crystalline and glassy statesJarmelo, Susana ; Maria, Teresa M. R. ; Leitão, Maria Luísa P. ; Fausto, Rui articleopenAccess
47May-1986A Molecular Mechanics Force Field for Conformational Analysis of Simple Acylchlorides, Carboxylic and EstersTeixeira-Dias, J. J. C. ; Fausto, Rui articleopenAccess
4828-Mar-2013Near-IR laser generation of a high-energy conformer of L-alanine and the mechanism of its decay in a low-temperature nitrogen matrixNunes, Cláudio M. ; Lapinski, Leszek ; Fausto, Rui ; Reva, Igor articleopenAccess
493-Aug-2000Infrared-Induced Rotamerization of Oxalic Acid Monomer in Argon MatrixMaçôas, Ermelinda M. S. ; Fausto, Rui ; Pettersson, Mika ; Khriachtchev, Leonid ; Räsänen, Markku articleopenAccess
5031-Dec-2003Rotational Isomerism in Acetic Acid: The First Experimental Observation of the High-Energy ConformerMaçôas, Ermelinda M. S. ; Khriachtchev, Leonid ; Pettersson, Mika ; Fausto, Rui ; Räsänen, Markku articleopenAccess
Results 1-50 of 112 (Search time: 0.835 seconds).