Geometry & MOs

Info

ID:	356928
PubChem CID:	127292536
Reduced:	O2N6C17H30 (1)
Stoich.:	A2B6C17D30 (1)
Weight, g/mol:	361.214761
ΔH_f, kcal/mol:	-45.74
Dipole, Da:	4.47
IP(EA), eV:	-8.23(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethylsulfonyl-N-[1-(4-methylpiperazin-1-yl)propan-2-yl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2CCCN(C2)C(=O)NC(C)CN3CCN(CC3)C

DOS

IR

Vibrations