Geometry & MOs

Info

ID:	154475
PubChem CID:	56313918
Reduced:	SN2F3O3C22H25 (1)
Stoich.:	AB2C3D3E22F25 (1)
Weight, g/mol:	357.174022
ΔH_f, kcal/mol:	-231.77
Dipole, Da:	3.82
IP(EA), eV:	-9.44(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2,4-dimethoxyphenyl)-N-[2-(2-fluorophenyl)-2-methylpropyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F)C3=CC=CC=C3F

DOS

IR

Vibrations