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Results: 1-25/40
Authors:
DOSSANTOS HF
OMALLEY PJ
DEALMEIDA WB
Citation: Hf. Dossantos et al., GAS-PHASE AND WATER SOLUTION CONFORMATIONAL-ANALYSIS OF THE HERBICIDEDIURON (DCMU) - AN AB-INITIO STUDY, Theoretical Chemistry accounts ( Theoretical Chemistry accounts (Print)), 99(5), 1998, pp. 301-311
Authors:
RESENDE SM
PLIEGO JR
DEALMEIDA WB
Citation: Sm. Resende et al., FREE-RADICAL MECHANISM OF THE CL-2 ADDITION TO ACETYLENE, Journal of the Chemical Society. Faraday transactions (Print), 94(19), 1998, pp. 2895-2900
Authors:
DOSSANTOS HF
DEALMEIDA WB
ZERNER MC
Citation: Hf. Dossantos et al., THEORETICAL NEAR UV AND VIS ELECTRONIC-SPECTRA FOR THE ZN-II-ANHYDROTETRACYCLINE COMPLEX, Journal of the Chemical Society. Perkin transactions. II (Print), (11), 1998, pp. 2519-2525
Authors:
DEALMEIDA WB
DOSSANTOS HF
ROCHA WR
ZERNER MC
Citation: Wb. Dealmeida et al., THEORETICAL-STUDIES OF METAL-COMPLEXES OF ANHYDROTETRACYCLINE - INTERACTION WITH ZN-II, Journal of the Chemical Society. Dalton transactions, (15), 1998, pp. 2531-2536
Authors:
ROCHA WR
DEALMEIDA WB
Citation: Wr. Rocha et Wb. Dealmeida, THEORETICAL-STUDY OF THE OLEFIN INSERTION REACTION IN THE HETEROBIMETALLIC PT(H)(PH3)(2)(SNCL3)(C2H4) COMPOUND, Organometallics, 17(10), 1998, pp. 1961-1967
Authors:
ROCHA WR
PLIEGO JR
RESENDE SM
DOSSANTOS HF
DEOLIVEIRA MA
DEALMEIDA WB
Citation: Wr. Rocha et al., AB-INITIO CONFORMATIONAL-ANALYSIS OF CYCLOOCTANE MOLECULE, Journal of computational chemistry, 19(5), 1998, pp. 524-534
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, THERMODYNAMICS OF YLIDE FORMATION FROM CARBENES AND CARBONYL-COMPOUNDS, Journal of the Brazilian Chemical Society, 9(2), 1998, pp. 181-186
Authors:
DEALMEIDA WB
DOSSANTOS HF
ZERNER MC
Citation: Wb. Dealmeida et al., A THEORETICAL-STUDY OF THE INTERACTION OF ANHYDROTETRACYCLINE WITH AL(III), Journal of pharmaceutical sciences, 87(9), 1998, pp. 1101-1108
Authors:
DOSSANTOS HF
DEALMEIDA WB
ZERNER MC
Citation: Hf. Dossantos et al., CONFORMATIONAL-ANALYSIS OF THE ANHYDROTETRACYCLINE MOLECULE - A TOXICDECOMPOSITION PRODUCT OF TETRACYCLINE, Journal of pharmaceutical sciences, 87(2), 1998, pp. 190-195
Authors:
PLIEGO JR
FRANCA MA
DEALMEIDA WB
Citation: Jr. Pliego et al., KINETICS OF THE H2O-PHASE AND IN SOLUTION BY AN INSERTION MECHANISM(CCL2 REACTION IN GAS), Chemical physics letters, 285(1-2), 1998, pp. 121-126
Authors:
RESENDE SM
DEALMEIDA WB
Citation: Sm. Resende et Wb. Dealmeida, THEORETICAL-STUDY OF THE ATMOSPHERIC REACTION BETWEEN DIMETHYL SULFIDE AND CHLORINE ATOMS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(50), 1997, pp. 9738-9744
Authors:
SILVA THA
OLIVEIRA AB
DEALMEIDA WB
Citation: Tha. Silva et al., CONFORMATIONAL-ANALYSIS OF THE ANTIMALARIAL AGENT QUININE, Structural chemistry, 8(2), 1997, pp. 95-107
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, ABSOLUTE PROTON AFFINITY AND BASICITY OF THE CARBENES CH2, CF2, CCL2,C(OH)(2), FCOH, CPH2 AND FLUORENYLIDENE, Journal of the Chemical Society. Faraday transactions, 93(10), 1997, pp. 1881-1883
Authors:
ROCHA WR
DEALMEIDA WB
Citation: Wr. Rocha et Wb. Dealmeida, QUANTUM-MECHANICAL VIBRATIONAL-SPECTRUM AND CONFORMATIONAL-ANALYSIS FOR THE 1,5-CYCLOOCTADIENE, Vibrational spectroscopy, 13(2), 1997, pp. 213-219
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, REACTION OF CCL2 WITH CH2NH AND THE FORMATION OF DIPOLAR AND BIRADICAL YLIDE STRUCTURES, Perkin transactions. 2, (11), 1997, pp. 2365-2369
Authors:
ROCHA WR
DEALMEIDA WB
Citation: Wr. Rocha et Wb. Dealmeida, QUANTUM-MECHANICAL AND MOLECULAR MECHANICS CONFORMATIONAL-ANALYSIS OF1,5-CYCLOOCTADIENE, Journal of computational chemistry, 18(2), 1997, pp. 254-259
Authors:
ALCANTARA AFD
PILOVELOSO D
STUMPF HO
DEALMEIDA WB
Citation: Afd. Alcantara et al., NMR AND SEMIEMPIRICAL CONFORMATIONAL-ANALYSIS OF THE YL-1,3-DIHYDROXY-4,4,5,5-TETRAMETHYLIMIDAZOLIDINES, Tetrahedron, 53(50), 1997, pp. 16911-16922
Authors:
RESENDE SM
DEALMEIDA WB
Citation: Sm. Resende et Wb. Dealmeida, AB-INITIO STUDY OF THE FORMATION OF MOLECULAR-COMPLEXES BETWEEN CL-2 AND C2H2, Molecular physics, 91(4), 1997, pp. 635-641
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, A THEORETICAL-STUDY OF THE HCHO- CYCLOADDITION OR YLIDE FORMATION(CCL2 REACTION ), The Journal of chemical physics, 106(9), 1997, pp. 3582-3586
Authors:
ROCHA WR
DEALMEIDA WB
Citation: Wr. Rocha et Wb. Dealmeida, REACTION-PATH FOR THE INSERTION REACTION OF SNCL2 INTO THE PT-CL BOND- AN AB-INITIO STUDY, International journal of quantum chemistry, 65(5), 1997, pp. 643-650
Authors:
RESENDE SM
DEALMEIDA WB
Citation: Sm. Resende et Wb. Dealmeida, A THEORETICAL-STUDY OF TUNNELING IN THE (HCCH)(2) COMPLEX, Chemical physics, 206(1-2), 1996, pp. 1-8
Authors:
PLIEGO JR
RESENDE SM
DEALMEIDA WB
Citation: Jr. Pliego et al., AB-INITIO MP2 STUDY OF THE HF-CENTER-DOT-CENTER-DOT-CENTER-DOT-CLF COMPLEX USING VARIOUS EXTENDED BASIS-SETS AND BOND FUNCTIONS, Theoretica Chimica Acta, 93(6), 1996, pp. 333-342
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, REACTION PATHS FOR AQUEOUS DECOMPOSITION OF CCL2, Journal of physical chemistry, 100(30), 1996, pp. 12410-12413
Authors:
PLIEGO JR
DEALMEIDA WB
Citation: Jr. Pliego et Wb. Dealmeida, SEARCHING FOR THE YLIDE STRUCTURE - AN AB-INITIO STUDY OF THE H2O...CCL2 COMPLEX, Chemical physics letters, 249(1-2), 1996, pp. 136-140
MOLECULAR-STRUCTURE AND INTERNAL MOTION IN THE (CO2)(3)CENTER-DOT-CENTER-DOT-CENTER-DOT-HCN TETRAMER
Authors:
DEALMEIDA WB
Citation: Wb. Dealmeida, MOLECULAR-STRUCTURE AND INTERNAL MOTION IN THE (CO2)(3)CENTER-DOT-CENTER-DOT-CENTER-DOT-HCN TETRAMER, SPECT ACT A, 51(4), 1995, pp. 653-660