Geometry & MOs

Info

ID:	206282
PubChem CID:	80225535
Reduced:	BrN2S2O3C13H15 (1)
Stoich.:	AB2C2D3E13F15 (1)
Weight, g/mol:	362.93986
ΔH_f, kcal/mol:	-68.92
Dipole, Da:	3.4
IP(EA), eV:	-8.0(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(4-fluoro-2-methylphenyl)-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(S1)Br)S(=O)(=O)NCC2=C(C=CC(=C2)N)OC

DOS

IR

Vibrations