Quantitative structure-retention relationship modelling of esters on stationary phases of different polarity

Journal of Molecular Graphics and Modelling

Volumn 28, Issue 1, 2009, Pages 20-27

  Souza, Érica Silva ^a   Kuhnen, Carlos Alberto ^a   Junkes, Berenice da Silva ^b   Yunes, Rosendo Augusto ^a   Heinzen, Vilma Edite Fonseca ^a  

^a FEDERAL UNIVERSITY OF SANTA CATARINA   (Brazil)

^b Science and Technology of Santa Catarina   (Brazil)

Author keywords

Chromatographic retention indices; QSRR; Saturated esters; Semi empirical electrotopological index; Topological indices

Indexed keywords

CHROMATOGRAPHIC RETENTION INDICES; QSRR; SATURATED ESTERS; SEMI-EMPIRICAL ELECTROTOPOLOGICAL INDEX; TOPOLOGICAL INDICES;

ATOMS; CHROMATOGRAPHIC ANALYSIS; ELECTRIC DIPOLE MOMENTS; ESTERIFICATION; FUNCTIONAL GROUPS; HYDROCARBONS; SULFUR COMPOUNDS; TRANSIENTS;

ESTERS;

ALKANE; ALKENE; CARBON; ESTER;

ARTICLE; CHROMATOGRAPHIC RETENTION INDICES; CHROMATOGRAPHY; LINEAR REGRESSION ANALYSIS; MOLECULAR INTERACTION; MOLECULAR MODEL; MOLECULE; PREDICTION; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTITATIVE STRUCTURE RETENTION RELATION; QUANTUM CHEMISTRY; QUANTUM MECHANICS; STATISTICAL ANALYSIS;

ESTERS; MODELS, CHEMICAL; MOLECULAR STRUCTURE; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; REGRESSION ANALYSIS;

EID: 69349089702     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2009.03.003     Document Type: Article

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