Geometry & MOs

Info

ID:	356929
PubChem CID:	127292537
Reduced:	SO3N5C15H31 (1)
Stoich.:	AB3C5D15E31 (1)
Weight, g/mol:	283.200825
ΔH_f, kcal/mol:	-139.29
Dipole, Da:	6.59
IP(EA), eV:	-8.44(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methylpiperazin-1-yl)propan-2-yl]-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C(=O)NC(C)CN2CCN(CC2)C

DOS

IR

Vibrations