Geometry & MOs

Info

ID:	447788
PubChem CID:	135285773
Reduced:	FSN2O5C19H19 (1)
Stoich.:	ABC2D5E19F19 (1)
Weight, g/mol:	429.050479
ΔH_f, kcal/mol:	-201.37
Dipole, Da:	7.86
IP(EA), eV:	-9.14(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-6-fluoro-3-(4-methylsulfonylphenyl)indole

Drug info:

PubChemData

Smile

C1C(C([C@@H](N1S(=O)(=O)C2=CC=C(C=C2)C3=CNC4=C3C=CC(=C4)F)CO)O)O

DOS

IR

Vibrations