Geometry & MOs

Info

ID:	355810
PubChem CID:	127290662
Reduced:	SO2N6C13H20 (1)
Stoich.:	AB2C6D13E20 (1)
Weight, g/mol:	385.157246
ΔH_f, kcal/mol:	-5.44
Dipole, Da:	3.15
IP(EA), eV:	-8.75(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-5-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]sulfonylquinoline

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)S(=O)(=O)C3=CN(N=C3)C

DOS

IR

Vibrations