Geometry & MOs

Info

ID:	172676
PubChem CID:	75539764
Reduced:	FSN2O3C19H21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	-114.45
Dipole, Da:	3.9
IP(EA), eV:	-9.68(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-methoxyphenyl)prop-2-enoylamino]-N-[2-(2-methylphenyl)ethyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CS(=O)(=O)NCCC(=O)NCCC2=CC=CC=C2F

DOS

IR

Vibrations