Geometry & MOs

Info

ID:	3253
PubChem CID:	9398
Reduced:	SF2N2H6O6C12 (1)
Stoich.:	AB2C2D6E6F12 (1)
Weight, g/mol:	343.991463
ΔH_f, kcal/mol:	-121.47
Dipole, Da:	1.52
IP(EA), eV:	-11.45(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-(4-fluoro-3-nitrophenyl)sulfonyl-2-nitrobenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])[N+](=O)[O-])F

DOS

IR

Vibrations