Geometry & MOs

Info

ID:	268134
PubChem CID:	103598002
Reduced:	SN3O3C21H21 (1)
Stoich.:	AB3C3D21E21 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	-20.01
Dipole, Da:	4.99
IP(EA), eV:	-8.72(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(3-methoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1OC2=NC=C(C=C2)CNC(=O)C=CC3=CSC(=N3)C

DOS

IR

Vibrations