TY - BOOK AU - Frisch, M J; Trucks, G W; Schlegel, H B; Scuseria, G E; Robb, M A; Cheeseman, J R; Scalmani, G; Barone, V; Mennucci, B; Petersson, G A; Nakatsuji, H; Caricato, M; Li, X; Hratchian, H P; Izmaylov, A F; Bloino, J; Zheng, G; Sonnenberg, J L; Hada, M; Ehara, M; Toyota, K; Fukuda, R; Hasegawa, J; Ishida, M; Nakajima, T; Honda, Y; Kitao, O; Nakai, H; Vreven, T; Montgomery, J A. Jr; Peralta, J E; Ogliaro, F; Bearpark, M; Heyd, J J; Brothers, E; Kudin, K N; Staroverov, V N; Kobayashi, R; Normand, J; Raghavachari, K; Rendell, A; Burant, J C; Iyengar, S S; Tomasi, J; Cossi, M; Rega, N; Millam, J M; Klene, M; Knox, J E; Cross, J B; Bakken, V; Adamo, C; Jaramillo, J; Gomperts, R; Stratmann, R E; Yazyev, O; Austin, A J; Cammi, R; Pomelli, C; Ochterski, J W; Martin, R L; Morokuma, K; Zakrzewski, V G; Voth, G A; Salvador, P; Dannenberg, J J; Dapprich, S; Daniels, A D; Farkas, Ö; Foresman, J B; Ortiz, J V; Cioslowski, J; Fox, D J TI - Gaussian 09, Revision A.01 CY - Wallingford CT PB - Gaussian, Inc PY - 2009 N1 - The optimization included the solvent effect correction calculated using the IEFPCM model with toluene taken as solvent. No symmetry operations were applied. The Hessian matrix was calculated analytically for the optimized structures to prove the location of correct minima (no imaginary frequencies) or saddle points (only one imaginary frequency) and to estimate the thermodynamic parameters, with the latter calculated at 25 °C ER -