Geometry & MOs

Info

ID:	379274
PubChem CID:	134357002
Reduced:	FO3N5C20H22 (1)
Stoich.:	AB3C5D20E22 (1)
Weight, g/mol:	252.111007
ΔH_f, kcal/mol:	-106.58
Dipole, Da:	1.85
IP(EA), eV:	-8.06(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-1-(2,2-dihydroxyethyl)-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C1=O)N(CCC2)CC(=O)N/C(=C/C=C(/C3=CC=CC=C3F)\N)/N

DOS

IR

Vibrations