Geometry & MOs

Info

ID:	394174
PubChem CID:	135022474
Reduced:	NSO4H17C20 (1)
Stoich.:	ABC4D17E20 (1)
Weight, g/mol:	343.043378
ΔH_f, kcal/mol:	-87.35
Dipole, Da:	6.83
IP(EA), eV:	-9.67(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-chloro-5-(4-methylphenyl)sulfonylphenyl]pyridine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)OC(=O)C)C3=CC=CC=N3

DOS

IR

Vibrations