Geometry & MOs

Info

ID:	345201
PubChem CID:	127268961
Reduced:	FSO2N3C20H32 (1)
Stoich.:	ABC2D3E20F32 (1)
Weight, g/mol:	397.129398
ΔH_f, kcal/mol:	-136.45
Dipole, Da:	2.75
IP(EA), eV:	-8.4(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-methylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)F)N2CCN(CC2)C)NS(=O)(=O)CC3CCCCC3

DOS

IR

Vibrations