Geometry & MOs

Info

ID:	374842
PubChem CID:	131349505
Reduced:	OSN2C8H10 (1)
Stoich.:	ABC2D8E10 (1)
Weight, g/mol:	208.084792
ΔH_f, kcal/mol:	10.77
Dipole, Da:	2.15
IP(EA), eV:	-8.6(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-methyl-2-oxo-5,7-dihydro-1H-pyrrolo[3,4-b]pyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=C(SC2=C1N=CO2)N

DOS

IR

Vibrations