Geometry & MOs

Info

ID:	138298
PubChem CID:	52342761
Reduced:	SO2N4C17H28 (1)
Stoich.:	AB2C4D17E28 (1)
Weight, g/mol:	344.224597
ΔH_f, kcal/mol:	-56.73
Dipole, Da:	1.04
IP(EA), eV:	-8.86(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonyl-4-methylpiperazine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)N3CCN(CC3)C

DOS

IR

Vibrations