Geometry & MOs

Info

ID:	165221
PubChem CID:	74519728
Reduced:	NO5H19C23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	324.111007
ΔH_f, kcal/mol:	-108.92
Dipole, Da:	6.2
IP(EA), eV:	-8.83(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-3-(4-hydroxy-3-methoxyphenyl)-N-(3-methoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C(=O)C=CC2=CC=C(O2)C3=CC=CC=C3C(=O)OC

DOS

IR

Vibrations