Geometry & MOs

Info

ID:	374141
PubChem CID:	131324304
Reduced:	FN2H9C10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	402.83899
ΔH_f, kcal/mol:	21.49
Dipole, Da:	3.13
IP(EA), eV:	-9.59(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-iodo-4-oxo-6-(trifluoromethoxy)-1H-pyridine-3-sulfonyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C#N)/C=C/CN

DOS

IR

Vibrations