Geometry & MOs

Info

ID:	260575
PubChem CID:	103195817
Reduced:	SO2N3C14H25 (1)
Stoich.:	AB2C3D14E25 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-106.45
Dipole, Da:	3.77
IP(EA), eV:	-8.8(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-methoxy-6-methylpyridin-2-yl)methyl]-2,3,4,4a,7,7a-hexahydro-1H-pyrrolo[3,4-b]pyridin-5-one

Drug info:

PubChemData

Smile

CCC(CC)(C(=S)N)C(=O)N1CCCC(C1)C(=O)NC

DOS

IR

Vibrations