Geometry & MOs

Info

ID:	358039
PubChem CID:	127295584
Reduced:	SO3N5C18H31 (1)
Stoich.:	AB3C5D18E31 (1)
Weight, g/mol:	332.151826
ΔH_f, kcal/mol:	-110.45
Dipole, Da:	5.86
IP(EA), eV:	-8.4(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]pyrrolidine-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)N3CCCCCC3

DOS

IR

Vibrations