Geometry & MOs

Info

ID:	278364
PubChem CID:	103835088
Reduced:	NSO3C16H27 (1)
Stoich.:	ABC3D16E27 (1)
Weight, g/mol:	296.119464
ΔH_f, kcal/mol:	-142.89
Dipole, Da:	6.85
IP(EA), eV:	-9.93(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(3-ethyl-2-hydroxypentyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNS(=O)(=O)C1=CC=C(C=C1)C(C)C)O

DOS

IR

Vibrations