Geometry & MOs

Info

ID:	177513
PubChem CID:	76195620
Reduced:	ON2H22C23 (1)
Stoich.:	AB2C22D23 (1)
Weight, g/mol:	312.127406
ΔH_f, kcal/mol:	51.53
Dipole, Da:	6.36
IP(EA), eV:	-9.07(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-(3-fluorophenyl)-3-(2-methylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NN=C(C)C(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations