Geometry & MOs

Info

ID:	366810
PubChem CID:	127320347
Reduced:	NSO4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	366.139548
ΔH_f, kcal/mol:	-136.85
Dipole, Da:	4.02
IP(EA), eV:	-8.97(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COCC1S(=O)(=O)NCC2CC3=CC=CC=C3O2

DOS

IR

Vibrations