Geometry & MOs

Info

ID:	50749
PubChem CID:	12013337
Reduced:	NSF2O2C19H21 (1)
Stoich.:	ABC2D2E19F21 (1)
Weight, g/mol:	345.119878
ΔH_f, kcal/mol:	-137.1
Dipole, Da:	6.39
IP(EA), eV:	-9.3(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butan-2-yl-2-fluoro-1-(4-methylphenyl)sulfonylindole

Drug info:

PubChemData

Smile

CCC(C)C(=C(F)F)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations