Geometry & MOs

Info

ID:	155855
PubChem CID:	56367888
Reduced:	ClF2S2N3O3H14C15 (1)
Stoich.:	AB2C2D3E3F14G15 (1)
Weight, g/mol:	408.051083
ΔH_f, kcal/mol:	-170.53
Dipole, Da:	5.25
IP(EA), eV:	-9.19(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=C(C(=CC=C1)Cl)SC(F)F)S(=O)(=O)C2=CN=CC=C2

DOS

IR

Vibrations