Geometry & MOs

Info

ID:	343224
PubChem CID:	127266397
Reduced:	ClSN3O3C16H28 (1)
Stoich.:	ABC3D3E16F28 (1)
Weight, g/mol:	341.177313
ΔH_f, kcal/mol:	-142.25
Dipole, Da:	3.16
IP(EA), eV:	-9.08(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methoxyphenyl)methyl]-3-(4-methylpiperazin-1-yl)propane-1-sulfonamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCCS(=O)(=O)NCC2=CC(=CC=C2)OC.Cl

DOS

IR

Vibrations