Filename = //ic.ac.uk/homes/ak7611/3rdyearlab/NEW_3RDYEARLAB/Lewis acids and bases/Isomer 2/AlCl2Br Isomer2 OPT 3-21G.log

AlCl2Br Isomer 2 Optimisation 3-21G
File Name = AlCl2Br Isomer2 OPT 3-21G
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 3-21G
Charge = 0
Spin = Singlet
E(RB3LYP) = -7438.04304836 a.u.
RMS Gradient Norm = 0.08853287 a.u.
Imaginary Freq = 
Dipole Moment = 3.2563 Debye
Point Group = C1
Job cpu time:       0 days  0 hours  4 minutes  4.6 seconds.