Geometry & MOs

Info

ID:	352858
PubChem CID:	127283948
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	353.177313
ΔH_f, kcal/mol:	-149.97
Dipole, Da:	4.67
IP(EA), eV:	-9.44(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-(oxolan-2-yl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)S(=O)(=O)C2CCCCC2

DOS

IR

Vibrations