Geometry & MOs

Info

ID:	278130
PubChem CID:	103833639
Reduced:	FNSO4C14H20 (1)
Stoich.:	ABCD4E14F20 (1)
Weight, g/mol:	311.076219
ΔH_f, kcal/mol:	-209.82
Dipole, Da:	4.54
IP(EA), eV:	-9.7(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(2-thiomorpholin-4-ylethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C(C)(C)C)NS(=O)(=O)C1=C(C=CC(=C1)F)C(=O)OC

DOS

IR

Vibrations