Geometry & MOs

Info

ID:	361569
PubChem CID:	127303761
Reduced:	SN3O5C18H27 (1)
Stoich.:	AB3C5D18E27 (1)
Weight, g/mol:	394.167477
ΔH_f, kcal/mol:	-180.36
Dipole, Da:	9.25
IP(EA), eV:	-8.86(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-[4-(5-oxopyrrolidine-2-carbonyl)piperazin-1-yl]ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCCN2CCN(CC2)C(=O)C3COCCO3

DOS

IR

Vibrations