Geometry & MOs

Info

ID:	230270
PubChem CID:	87570550
Reduced:	FN2S2O4H19C22 (1)
Stoich.:	AB2C2D4E19F22 (1)
Weight, g/mol:	345.033876
ΔH_f, kcal/mol:	-126.81
Dipole, Da:	5.05
IP(EA), eV:	-9.18(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-pyridin-3-ylpyridin-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCN1C(COC1=O)CC2=CC=C(C=C2)OC3=CC(=C(C=C3)/C=C\4/C(=O)NC(=S)S4)F

DOS

IR

Vibrations