Geometry & MOs

Info

ID:	278315
PubChem CID:	103834792
Reduced:	S2N3O5C11H19 (1)
Stoich.:	A2B3C5D11E19 (1)
Weight, g/mol:	338.040642
ΔH_f, kcal/mol:	-176.71
Dipole, Da:	4.49
IP(EA), eV:	-8.88(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[2-(3-hydroxypropylsulfanyl)ethyl]-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NN=C1)S(=O)(=O)NCCSCCCO

DOS

IR

Vibrations