Geometry & MOs

Info

ID:	153326
PubChem CID:	56312508
Reduced:	FO2N4C20H21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	353.10612
ΔH_f, kcal/mol:	-55.44
Dipole, Da:	4.29
IP(EA), eV:	-9.69(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)sulfanyl-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCN1C(=O)C2=CC=CC=C2N=N1)C3=CC=CC=C3F

DOS

IR

Vibrations