Geometry & MOs

Info

ID:	373760
PubChem CID:	131319730
Reduced:	FINO4H5C9 (1)
Stoich.:	ABCD4E5F9 (1)
Weight, g/mol:	332.896654
ΔH_f, kcal/mol:	-73.87
Dipole, Da:	3.94
IP(EA), eV:	-10.57(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-5-sulfanyl-4-(trifluoromethylsulfanyl)benzenesulfonyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1[N+](=O)[O-])F)C=CC(=O)O)I

DOS

IR

Vibrations