Geometry & MOs

Info

ID:	155517
PubChem CID:	56365853
Reduced:	OSF2N2Cl3H7C13 (1)
Stoich.:	ABC2D2E3F7G13 (1)
Weight, g/mol:	391.960075
ΔH_f, kcal/mol:	-101.18
Dipole, Da:	2.35
IP(EA), eV:	-9.6(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)SC(F)F)NC(=O)C2=CC(=C(N=C2)Cl)Cl

DOS

IR

Vibrations