Geometry & MOs

Info

ID:	347771
PubChem CID:	127272833
Reduced:	FSN2O2C11H15 (1)
Stoich.:	ABC2D2E11F15 (1)
Weight, g/mol:	343.100205
ΔH_f, kcal/mol:	-106.31
Dipole, Da:	3.97
IP(EA), eV:	-9.77(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-fluoropyridin-3-yl)sulfonylpiperazin-1-yl]-(oxolan-2-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)C2=CN=CC(=C2)F

DOS

IR

Vibrations