Geometry & MOs

Info

ID:	283887
PubChem CID:	104016880
Reduced:	NSO3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	285.080121
ΔH_f, kcal/mol:	-113.96
Dipole, Da:	3.62
IP(EA), eV:	-9.1(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-1-[[4-(hydroxymethyl)phenyl]methyl]indole-2,3-dione

Drug info:

PubChemData

Smile

COC(=O)C(CSCC1=CC=C(C=C1)CO)N

DOS

IR

Vibrations