Geometry & MOs

Info

ID:	27183
PubChem CID:	819053
Reduced:	FSO2H3C5 (1)
Stoich.:	ABC2D3E5 (1)
Weight, g/mol:	234.90357
ΔH_f, kcal/mol:	-96.48
Dipole, Da:	4.01
IP(EA), eV:	-10.2(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-5-chloropyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(SC=C1C(=O)O)F

DOS

IR

Vibrations