Geometry & MOs

Info

ID:	357720
PubChem CID:	127294394
Reduced:	FSO2N4C16H25 (1)
Stoich.:	ABC2D4E16F25 (1)
Weight, g/mol:	341.188546
ΔH_f, kcal/mol:	-97.86
Dipole, Da:	4.55
IP(EA), eV:	-8.69(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCCCC1CN2CCN(CC2)S(=O)(=O)C3=CN=CC(=C3)F

DOS

IR

Vibrations