Geometry & MOs

Info

ID:	168045
PubChem CID:	74915170
Reduced:	NO4C24H25 (1)
Stoich.:	AB4C24D25 (1)
Weight, g/mol:	476.209993
ΔH_f, kcal/mol:	-80.74
Dipole, Da:	6.59
IP(EA), eV:	-8.58(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(dimethylamino)phenyl]-3-(6-methoxy-3-naphthalen-1-yl-1-benzofuran-5-yl)but-2-enamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)NCC=C)C)OC

DOS

IR

Vibrations