Geometry & MOs

Info

ID:	375243
PubChem CID:	131481027
Reduced:	FN3C12H14 (1)
Stoich.:	AB3C12D14 (1)
Weight, g/mol:	210.080456
ΔH_f, kcal/mol:	7.4
Dipole, Da:	4.73
IP(EA), eV:	-8.33(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-6-fluoro-3-(hydroxymethyl)-7-methyl-1H-indol-2-one

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)CCC2=CC=C(C=C2)F)N

DOS

IR

Vibrations