Chemical and molecular descriptors for the reactivity of amines with CO 2

Industrial and Engineering Chemistry Research

Volumn 51, Issue 42, 2012, Pages 13609-13618

  Lee, Anita S ^a,b   Kitchin, John R ^a,b  

^a NATIONAL ENERGY TECHNOLOGY LABORATORY   (United States)

^b CARNEGIE MELLON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALKANOLAMINES; ALKYL AMINES; CARBAMATE SPECIES; CARBAMIC ACID; CHEMICAL CORRELATION; COMPUTATIONAL STUDIES; DESCRIPTORS; ELECTRON WITHDRAWING GROUP; ELECTRON-DONATING GROUP; ELECTRONWITHDRAWING; FLUORINATED ALKYLAMINES; FORMATION ENERGIES; FUNCTIONALIZATIONS; FUNCTIONALIZED; LOCAL SOFTNESS; MOLECULAR DESCRIPTORS; PROCESS MODIFICATIONS; PROXIMITY EFFECTS; TERTIARY AMINE;

AMINES; ELECTRONEGATIVITY; ELECTRONIC STRUCTURE; HYDROGEN BONDS; ORGANIC ACIDS; REACTION PRODUCTS;

CARBON DIOXIDE;

EID: 84867809683     PISSN: 08885885     EISSN: 15205045     Source Type: Journal    
DOI: 10.1021/ie301419q     Document Type: Article

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