Geometry & MOs

Info

ID:	433039
PubChem CID:	135173176
Reduced:	SN2O2C10H14 (1)
Stoich.:	AB2C2D10E14 (1)
Weight, g/mol:	206.105528
ΔH_f, kcal/mol:	-61.61
Dipole, Da:	7.69
IP(EA), eV:	-9.42(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,3-dimethyl-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(CN(C2)S(=O)(=O)C)N=C1C

DOS

IR

Vibrations