Geometry & MOs

Info

ID:	253855
PubChem CID:	103121133
Reduced:	ON4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	20.22
Dipole, Da:	1.57
IP(EA), eV:	-8.92(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl(pyrazolo[1,5-a]pyridin-3-yl)methanone

Drug info:

PubChemData

Smile

C1C[C@H]2CN(C[C@H]2NC1)C(=O)C3=C4C=CC=CN4N=C3

DOS

IR

Vibrations