Geometry & MOs

Info

ID:	195970
PubChem CID:	78756010
Reduced:	FSN3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	374.058883
ΔH_f, kcal/mol:	12.03
Dipole, Da:	4.33
IP(EA), eV:	-8.44(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[3-(2,4-dichlorophenyl)prop-2-enoylamino]benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(CNC(=S)NC2=CC=CC=C2F)C3=CC=CC=C3

DOS

IR

Vibrations