Search results for "ANTHRACENE"
showing 10 items of 171 documents
CCDC 826707: Experimental Crystal Structure Determination
2012
Related Article: L.Plasseraud, B.Therrien, A.Ruzicka, H.Cattey|2012|Inorg.Chim.Acta|380|50|doi:10.1016/j.ica.2011.08.042
CCDC 1562676: Experimental Crystal Structure Determination
2017
Related Article: György Szalóki, Vincent Croué, Vincent Carré, Frédéric Aubriet, Olivier Alévêque, Eric Levillain, Magali Allain, Juan Aragó, Enrique Ortí, Sébastien Goeb, Marc Sallé|2017|Angew.Chem.,Int.Ed.|56|16272|doi:10.1002/anie.201709483
CCDC 948414: Experimental Crystal Structure Determination
2015
Related Article: María Castellano, Wdeson P. Barros, Alvaro Acosta, Miguel Julve, Francesc Lloret, Yanling Li, Yves Journaux, Giovanni De Munno, Donatella Armentano, Rafael Ruiz-García, Joan Cano|2014|Chem.-Eur.J.|20|13965|doi:10.1002/chem.201403987
CCDC 828222: Experimental Crystal Structure Determination
2011
Related Article: M.Castellano, J.Ferrando-Soria, E.Pardo, M.Julve, F.Lloret, C.Mathoniere, J.Pasan, C.Ruiz-Perez, L.Canadillas-Delgado, R.Ruiz-Garcia, J.Cano|2011|Chem.Commun.|47|11035|doi:10.1039/c1cc15087a
CCDC 1949612: Experimental Crystal Structure Determination
2020
Related Article: Justin J. Dressler, Abel Cárdenas Valdivia, Ryohei Kishi, Gabriel E. Rudebusch, Austin M. Ventura, Brian E. Chastain, Carlos J. Gómez-García, Lev N. Zakharov, Masayoshi Nakano, Juan Casado, Michael M. Haley|2020|Cell Press: Chem|6|1353|doi:10.1016/j.chempr.2020.02.010
CCDC 1965270: Experimental Crystal Structure Determination
2020
Related Article: Manuel Meneses-Sánchez, Lucía Piñeiro-López, Teresa Delgado, Carlos Bartual-Murgui, M. Carmen Muñoz, Pradip Chakraborty, José Antonio Real|2020|J.Mater.Chem.C|8|1623|doi:10.1039/C9TC06422B
CCDC 1949613: Experimental Crystal Structure Determination
2020
Related Article: Justin J. Dressler, Abel Cárdenas Valdivia, Ryohei Kishi, Gabriel E. Rudebusch, Austin M. Ventura, Brian E. Chastain, Carlos J. Gómez-García, Lev N. Zakharov, Masayoshi Nakano, Juan Casado, Michael M. Haley|2020|Cell Press: Chem|6|1353|doi:10.1016/j.chempr.2020.02.010
Stereoselective metabolism of dibenz(a,h)anthracene to trans-dihydrodiols and their activation to bacterial mutagens.
1990
Dibenz(a,h)anthracene (DBA), a carcinogenic, polycyclic aromatic hydrocarbon ubiquitous in the environment, is metabolized by the hepatic microsomal fraction of immature Sprague-Dawley rats pretreated with Aroclor 1254 to 27 ethyl acetate-extractable metabolites. More than half of these metabolites (51%) consisted of trans-1,2-; -3,4-; and -5,6-dihydrodiols including their identified secondary metabolites. The three trans-dihydrodiols (4.9, 15.8, and 0.6% of total metabolic conversion) were highly enriched in their R,R enantiomers (85, 71, and 98%) as determined by high performance liquid chromatography on suitable chiral stationary phases. This is explained on the basis of the stereoselect…
DFT studies of COOH tip-functionalized zigzag and armchair single wall carbon nanotubes
2011
Structure and energy calculations of pristine and COOH-modified model single wall carbon nanotubes (SWCNTs) of different length were performed at B3LYP/6-31G* level of theory. From 1 to 9 COOH groups were added at the end of the nanotube. The differences in structure and energetics of partially and fully functionalized SWCNTs at one end of the nanotube are observed. Up to nine COOH groups could be added at one end of (9,0) zigzag SWCNT in case of full functionalization. However, for (5,5) armchair SWCNT, the full functionalization was impossible due to steric crowding and rim deformation. The dependence of substituent attachment energy on the number of substituents at the carbon nanotube ri…
CCDC 919043: Experimental Crystal Structure Determination
2013
Related Article: María Castellano, Wdeson P. Barros, Alvaro Acosta, Miguel Julve, Francesc Lloret, Yanling Li, Yves Journaux, Giovanni De Munno, Donatella Armentano, Rafael Ruiz-García, Joan Cano|2014|Chem.-Eur.J.|20|13965|doi:10.1002/chem.201403987