Geometry & MOs

Info

ID:	26749
PubChem CID:	798023
Reduced:	N3H11C15 (1)
Stoich.:	A3B11C15 (1)
Weight, g/mol:	333.06872
ΔH_f, kcal/mol:	132.8
Dipole, Da:	8.19
IP(EA), eV:	-8.9(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dichlorophenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

C=CCN1C=C(C2=CC=CC=C21)C=C(C#N)C#N

DOS

IR

Vibrations