Geometry & MOs

Info

ID:	155509
PubChem CID:	56365845
Reduced:	ClF2N2S2O3C19H19 (1)
Stoich.:	AB2C2D2E3F19G19 (1)
Weight, g/mol:	420.93505
ΔH_f, kcal/mol:	-186.02
Dipole, Da:	5.04
IP(EA), eV:	-9.3(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-5-methoxybenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)SC(F)F)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations