Geometry & MOs

Info

ID:	202657
PubChem CID:	79706596
Reduced:	BSO2F3H10C13 (1)
Stoich.:	ABC2D3E10F13 (1)
Weight, g/mol:	268.048922
ΔH_f, kcal/mol:	-245.78
Dipole, Da:	1.75
IP(EA), eV:	-9.27(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-fluoro-5-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]boronic acid

Drug info:

PubChemData

Smile

B(C1=CC(=CC(=C1)F)CSC2=CC(=C(C=C2)F)F)(O)O

DOS

IR

Vibrations