Geometry & MOs

Info

ID:	192263
PubChem CID:	78250443
Reduced:	SO2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	295.103085
ΔH_f, kcal/mol:	-7.35
Dipole, Da:	4.98
IP(EA), eV:	-8.96(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2,4-dimethylanilino)ethenyl]-1-benzothiophen-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)SCC2CC(=O)NC(N2)NC3=NC4=CC=CC=C4O3

DOS

IR

Vibrations