Geometry & MOs

Info

ID:	155462
PubChem CID:	56365701
Reduced:	FSN2O8C19H21 (1)
Stoich.:	ABC2D8E19F21 (1)
Weight, g/mol:	371.055834
ΔH_f, kcal/mol:	-328.44
Dipole, Da:	6.82
IP(EA), eV:	-8.67(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-3-(4-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)N)NS(=O)(=O)C2=CC(=C(C=C2)OCCCC(=O)O)F)OC

DOS

IR

Vibrations