Density functional theory study of the carbonyl-ene reaction of encapsulated formaldehyde in Cu(I), Ag(I), and Au(I) exchanged FAU zeolites

Journal of Physical Chemistry A

Volumn 115, Issue 45, 2011, Pages 12486-12492

  Wannakao, Sippakorn ^a   Khongpracha, Pipat ^a   Limtrakul, Jumras ^a  

^a KASETSART UNIVERSITY   (Thailand)

Author keywords

[No Author keywords available]

Indexed keywords

C-C BOND FORMATION; CARBONYL-ENE REACTIONS; CHEMICAL SYNTHESIS; FAU ZEOLITES; FAUJASITE ZEOLITES; METAL CATION; NBO ANALYSIS; PROBE MOLECULES; PRODUCT DESORPTION; REACTANT MOLECULES; REACTION CATALYZED; TRANSITION STRUCTURES;

ACTIVATION ENERGY; CARBONYLATION; CATALYSIS; CHARGE TRANSFER; CHEMICAL BONDS; DESORPTION; FORMALDEHYDE; IODINE; ION EXCHANGE; PROPYLENE; SILICATE MINERALS; SILVER COMPOUNDS; SYNTHESIS (CHEMICAL);

DENSITY FUNCTIONAL THEORY;

ALKENE; COPPER; FORMALDEHYDE; GOLD; ORGANOMETALLIC COMPOUND; PROPYLENE; SILVER; ZEOLITE;

ARTICLE; CATALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; QUANTUM THEORY;

ALKENES; CATALYSIS; COPPER; FORMALDEHYDE; GOLD; MODELS, MOLECULAR; ORGANOMETALLIC COMPOUNDS; QUANTUM THEORY; SILVER; ZEOLITES;

EID: 80855139895     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp205985v     Document Type: Article

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