Geometry & MOs

Info

ID:	278515
PubChem CID:	103836353
Reduced:	SN2O3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	279.150429
ΔH_f, kcal/mol:	-90.13
Dipole, Da:	4.88
IP(EA), eV:	-10.2(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-hydroxyethyl)pentyl]-1-(oxolan-2-yl)methanesulfonamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNS(=O)(=O)C1=CC=C(C=C1)C#N

DOS

IR

Vibrations