Geometry & MOs

Info

ID:	21734
PubChem CID:	589705
Reduced:	FSCl2N2O3H7C8 (1)
Stoich.:	ABC2D2E3F7G8 (1)
Weight, g/mol:	299.953847
ΔH_f, kcal/mol:	-117.74
Dipole, Da:	4.58
IP(EA), eV:	-9.68(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1-amino-2-chloroethylidene)amino] 3-chloro-4-fluorobenzenesulfonate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1S(=O)(=O)ON=C(CCl)N)Cl)F

DOS

IR

Vibrations