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Mario Tulio dos Santos Rosado
AuthID:
R-000-CZQ
Publicações
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Document Source:
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Document Type:
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Article (27)
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Order:
Year Dsc
Year Asc
Cit. WOS Dsc
IF WOS Dsc
Cit. Scopus Dsc
IF Scopus Dsc
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Results:
10
20
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Confirmed Publications: 27
11
TITLE:
Structure of isolated 1,4-butanediol: Combination of MP2 calculations, NBO analysis, and matrix-isolation infrared spectroscopy
AUTHORS:
Lopes J L Jesus
;
Mario T S Rosado
;
Igor Reva
;
Rui Fausto
;
Ermelinda E S Eusebio
; Redinha, JS;
PUBLISHED:
2008
,
SOURCE:
JOURNAL OF PHYSICAL CHEMISTRY A,
VOLUME:
112,
ISSUE:
20
INDEXED IN:
Scopus
WOS
CrossRef
:
49
IN MY:
ORCID
|
ResearcherID
12
TITLE:
Structure of the 2-isopropylaminoethanol isolated molecule: Conformational analysis and intramolecular interactions
Full Text
AUTHORS:
Sandra C C Nunes
;
Ermelinda E S Eusebio
;
Lopes J L Jesus
;
Mario T S Rosado
; Redinha, JS;
PUBLISHED:
2008
,
SOURCE:
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
VOLUME:
863,
ISSUE:
1-3
INDEXED IN:
Scopus
WOS
CrossRef
:
4
IN MY:
ORCID
|
ResearcherID
13
TITLE:
The structure of betaxolol from single crystal X-ray diffraction and natural bond orbital analysis
Full Text
AUTHORS:
Joao Canotilho
;
Ricardo A E Castro
;
Mario T S Rosado
;
Ramos R Silva
;
Matos M Beja
;
Paixao, JA
; Simoes S Redinha;
PUBLISHED:
2008
,
SOURCE:
JOURNAL OF MOLECULAR STRUCTURE,
VOLUME:
891,
ISSUE:
1-3
INDEXED IN:
Scopus
WOS
CrossRef
:
4
IN MY:
ORCID
|
ResearcherID
14
TITLE:
Conformational study of isolated pindolol by HF, DFT and MP2 calculations
Full Text
AUTHORS:
Sandra C C Nunes
;
Lopes J L Jesus
;
Mario Tulio S Rosado
;
Ermelinda E S Eusebio
;
PUBLISHED:
2007
,
SOURCE:
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
VOLUME:
806,
ISSUE:
1-3
INDEXED IN:
Scopus
WOS
CrossRef
:
7
IN MY:
ORCID
|
ResearcherID
15
TITLE:
Enthalpy of sublimation/vaporization of trans-cyclohexyl-1,4-diamine and cis-cyclohexyl-1, 2-diamine
Full Text
AUTHORS:
Luciana I N Tome
;
Mario T S Rosado
;
Sandra C C Nunes
;
Teresa M R Maria
; Joao Canotilho;
Ermelinda E S Eusebio
;
PUBLISHED:
2007
,
SOURCE:
JOURNAL OF CHEMICAL THERMODYNAMICS,
VOLUME:
39,
ISSUE:
10
INDEXED IN:
Scopus
WOS
IN MY:
ORCID
|
ResearcherID
16
TITLE:
Hydration of cyclohexylamines: CPCM calculation of hydration gibbs energy of the conformers
AUTHORS:
Lopes J L Jesus
;
Luciana I N Tome
;
Ermelinda E S Eusebio
;
Mario T S Rosado
; Redinha, JS;
PUBLISHED:
2007
,
SOURCE:
JOURNAL OF PHYSICAL CHEMISTRY A,
VOLUME:
111,
ISSUE:
17
INDEXED IN:
Scopus
WOS
CrossRef
:
14
IN MY:
ORCID
|
ResearcherID
17
TITLE:
Molecular structure of mono- and 1,2-aminoderivatives of cyclohexane: Steric strain effects as determining factors
Full Text
AUTHORS:
Tome, LIN
;
Rosado, MTS
; Ermelinda, M; Eusebio, S; Redinha, JS;
PUBLISHED:
2007
,
SOURCE:
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
VOLUME:
804,
ISSUE:
1-3
INDEXED IN:
Scopus
WOS
IN MY:
ORCID
|
ResearcherID
18
TITLE:
Conformational study of monomeric 2,3-butanediols by matrix-isolation infrared spectroscopy and DFT calculations
AUTHORS:
Jesus, AJL
;
Rosado, MTS
;
Reva, I
;
Fausto, R
;
Eusebio, ME
; Redinha, JS;
PUBLISHED:
2006
,
SOURCE:
JOURNAL OF PHYSICAL CHEMISTRY A,
VOLUME:
110,
ISSUE:
12
INDEXED IN:
Scopus
WOS
CrossRef
:
44
IN MY:
ORCID
|
ResearcherID
19
TITLE:
Stepwise conformational cooling towards a single isomeric state in the four internal rotors system 1,2-butanediol
Full Text
AUTHORS:
Igor D Reva
;
Antonio J L Lopes Jesus
;
Mario T S Rosado
;
Rui Fausto
;
Ermelinda Eusebio, ME
; Redinha, JS;
PUBLISHED:
2006
,
SOURCE:
PHYSICAL CHEMISTRY CHEMICAL PHYSICS,
VOLUME:
8,
ISSUE:
45
INDEXED IN:
Scopus
WOS
CrossRef
:
48
IN MY:
ORCID
|
ResearcherID
20
TITLE:
Conformational study of erythritol and threitol in the gas state by density functional theory calculations
Full Text
AUTHORS:
Jesus, AJL
;
Tome, LIN
;
Rosado, MTS
;
Leitao, MLP
; Redinha, JS;
PUBLISHED:
2005
,
SOURCE:
CARBOHYDRATE RESEARCH,
VOLUME:
340,
ISSUE:
2
INDEXED IN:
Scopus
WOS
CrossRef
:
4
IN MY:
ORCID
|
ResearcherID
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