Geometry & MOs

Info

ID:	59960
PubChem CID:	26512259
Reduced:	N2O3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-60.9
Dipole, Da:	7.58
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.756720
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]ethanone

Drug info:

PubChemData

Smile

C[NH+](CC1=C(C=C(C=C1)OC)OC)CC(=O)N2CCCC3=CC=CC=C32

DOS

IR

Vibrations