Geometry & MOs

Info

ID:	201794
PubChem CID:	79586061
Reduced:	ClSN2O2C11H17 (1)
Stoich.:	ABC2D2E11F17 (1)
Weight, g/mol:	314.085577
ΔH_f, kcal/mol:	-84.08
Dipole, Da:	3.83
IP(EA), eV:	-9.81(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(2-cyanophenyl)methyl]-N-ethyl-2-methylpropane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CNS(=O)(=O)CC(C)CCl

DOS

IR

Vibrations