Geometry & MOs

Info

ID:	340551
PubChem CID:	127262562
Reduced:	SO2N3H5C6 (1)
Stoich.:	AB2C3D5E6 (1)
Weight, g/mol:	195.970329
ΔH_f, kcal/mol:	-18.3
Dipole, Da:	5.37
IP(EA), eV:	-9.27(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-chloro-4-fluorobenzoate

Drug info:

PubChemData

Smile

C1=CN2C(=C(SC2=N1)N)C(=O)O

DOS

IR

Vibrations