Geometry & MOs

Info

ID:	260596
PubChem CID:	103196493
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-34.14
Dipole, Da:	5.54
IP(EA), eV:	-9.63(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2-dimethyl-3-(5-oxo-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-1-yl)propanoate

Drug info:

PubChemData

Smile

CCCN=C(N)N1CCCC2C1CNC2=O

DOS

IR

Vibrations