Geometry & MOs

Info

ID:	314518
PubChem CID:	126622020
Reduced:	FSO2N3C20H24 (1)
Stoich.:	ABC2D3E20F24 (1)
Weight, g/mol:	318.103814
ΔH_f, kcal/mol:	-83.47
Dipole, Da:	6.33
IP(EA), eV:	-8.77(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-piperazin-1-ylphenyl)sulfonylphenol

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)N4CCNCC4)F

DOS

IR

Vibrations