Geometry & MOs

Info

ID:	345280
PubChem CID:	127269438
Reduced:	SO4N5C16H27 (1)
Stoich.:	AB4C5D16E27 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-117.72
Dipole, Da:	5.59
IP(EA), eV:	-8.83(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-ethylpiperazin-1-yl)propyl]-4-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

CCC1=NOC(=C1C(=O)N2CCN(CC2)S(=O)(=O)N3CCN(CC3)C)C

DOS

IR

Vibrations