Geometry & MOs

Info

ID:	357717
PubChem CID:	127294391
Reduced:	SO3N5C18H27 (1)
Stoich.:	AB3C5D18E27 (1)
Weight, g/mol:	355.204196
ΔH_f, kcal/mol:	-43.57
Dipole, Da:	4.91
IP(EA), eV:	-8.69(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[(1-methylpiperidin-2-yl)methyl]piperazine

Drug info:

PubChemData

Smile

CC1=NOC2=C1C=C(C=N2)S(=O)(=O)N3CCN(CC3)CC4CCCCN4C

DOS

IR

Vibrations