Geometry & MOs

Info

ID:	206283
PubChem CID:	80225570
Reduced:	BrFNO2S2H11C12 (1)
Stoich.:	ABCD2E2F11G12 (1)
Weight, g/mol:	388.93911
ΔH_f, kcal/mol:	-79.33
Dipole, Da:	5.01
IP(EA), eV:	-9.44(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(5-bromo-2-methylthiophen-3-yl)sulfonylamino]benzoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)NS(=O)(=O)C2=C(SC(=C2)Br)C

DOS

IR

Vibrations