Geometry & MOs

Info

ID:	183581
PubChem CID:	77042784
Reduced:	FNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	291.046235
ΔH_f, kcal/mol:	-113.71
Dipole, Da:	3.83
IP(EA), eV:	-8.64(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)-N-(2-fluoro-4-hydroxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CCC=C(C)C(=O)NC1=C(C=C(C=C1)O)F

DOS

IR

Vibrations