Geometry & MOs

Info

ID:	61347
PubChem CID:	26708415
Reduced:	O2N3H19C22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	334.131742
ΔH_f, kcal/mol:	-7.2
Dipole, Da:	5.93
IP(EA), eV:	-8.6(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3,5-dimethoxyphenyl)-N-quinolin-8-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC(=O)N1C=CC2=CC=CC=C2[C@H]1CC(=O)NC3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations