Geometry & MOs

Info

ID:	158110
PubChem CID:	56462997
Reduced:	NOS2F3H16C19 (1)
Stoich.:	ABC2D3E16F19 (1)
Weight, g/mol:	374.124212
ΔH_f, kcal/mol:	-136.26
Dipole, Da:	4.34
IP(EA), eV:	-8.86(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-prop-2-enyl-2-[[(E)-4,4,4-trifluoro-3-phenylbut-2-enoyl]amino]benzamide

Drug info:

PubChemData

Smile

C1CSC(S1)C2=CC(=CC=C2)NC(=O)/C=C(\C3=CC=CC=C3)/C(F)(F)F

DOS

IR

Vibrations