Geometry & MOs

Info

ID:	171995
PubChem CID:	75451154
Reduced:	SN2O2C13H18 (1)
Stoich.:	AB2C2D13E18 (1)
Weight, g/mol:	321.033876
ΔH_f, kcal/mol:	-20.29
Dipole, Da:	4.29
IP(EA), eV:	-10.08(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-cyano-N-[(6-methylpyridin-3-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C=CCCS(=O)(=O)NCC1(CC1)C2=CC=NC=C2

DOS

IR

Vibrations