Geometry & MOs

Info

ID:	171529
PubChem CID:	75389590
Reduced:	SN2O6C15H18 (1)
Stoich.:	AB2C6D15E18 (1)
Weight, g/mol:	276.013555
ΔH_f, kcal/mol:	-200.55
Dipole, Da:	6.05
IP(EA), eV:	-10.41(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(1-cyanopropyl)-4-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(C)(C#N)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)OC)C(=O)OC

DOS

IR

Vibrations