Geometry & MOs

Info

ID:	357207
PubChem CID:	127293711
Reduced:	SO2N5C20H23 (1)
Stoich.:	AB2C5D20E23 (1)
Weight, g/mol:	370.203862
ΔH_f, kcal/mol:	-14.38
Dipole, Da:	0.92
IP(EA), eV:	-8.5(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclohexen-1-yl)-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NC=CN=C2)C(=O)CCC(=O)N3CCSC4=CC=CC=C43

DOS

IR

Vibrations