Geometry & MOs

Info

ID:	291934
PubChem CID:	113862957
Reduced:	FNO3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	400.8755
ΔH_f, kcal/mol:	-155.43
Dipole, Da:	3.18
IP(EA), eV:	-8.98(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dibromophenyl)sulfonylpyrrolidine-3,4-diol

Drug info:

PubChemData

Smile

C1C(OC2=C1C=C(C=C2)F)CN3CC(C(C3)O)O

DOS

IR

Vibrations