Geometry & MOs

Info

ID:	128777
PubChem CID:	51057542
Reduced:	ClNO2H16C20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	357.032334
ΔH_f, kcal/mol:	-4.43
Dipole, Da:	6.86
IP(EA), eV:	-8.86(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(2,4-dichlorophenyl)-3-(5-phenylfuran-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3

DOS

IR

Vibrations