6533b7d9fe1ef96bd126ccb2

RESEARCH PRODUCT

Conformational analysis of methyl-substituted 9,10-dihydroanthracenes

Gianfranco La MannaM. Concetta NatoliGianfranco Fontana

subject

Computational chemistryChemistrydihydroanthracenering puckeringPhysical and Theoretical ChemistryDFF calculationCondensed Matter PhysicsRing (chemistry)Biochemistry

description

The amount of the ring puckering in methyl-substituted 9,10- dihydroanthracene was theoretically determined through DFT calculations. Theoretical calculations allowed to obtain the geometrical structures and energetic data on the different considered isomers.

yearjournalcountryeditionlanguage
2005-04-01
10.1016/j.theochem.2004.11.044http://hdl.handle.net/10447/30085