Geometry & MOs

Info

ID:	199082
PubChem CID:	79195803
Reduced:	SN2O2F3C11H11 (1)
Stoich.:	AB2C2D3E11F11 (1)
Weight, g/mol:	296.040168
ΔH_f, kcal/mol:	-196.19
Dipole, Da:	5.07
IP(EA), eV:	-10.43(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-imidazol-2-ylsulfamoyl)phenyl]ethanethioamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC#N)S(=O)(=O)NCCC(F)(F)F

DOS

IR

Vibrations