Geometry & MOs

Info

ID:	196866
PubChem CID:	78889143
Reduced:	NOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	326.082205
ΔH_f, kcal/mol:	7.8
Dipole, Da:	6.38
IP(EA), eV:	-9.03(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-(2-chlorophenyl)-2-cyano-3-(3-ethoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)/C=C(/C#N)\C(=O)NC2=CC=CC=C2

DOS

IR

Vibrations