Geometry & MOs

Info

ID:	441347
PubChem CID:	135234245
Reduced:	OF2N6H18C20 (1)
Stoich.:	AB2C6D18E20 (1)
Weight, g/mol:	360.169859
ΔH_f, kcal/mol:	-47.33
Dipole, Da:	4.42
IP(EA), eV:	-8.53(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-6-pyridin-3-ylpyridin-2-yl)-6-ethyl-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1C2=CC(=NC=C2CN1C(=O)NC3=C(C=CC(=N3)C4=CN=CC=C4)N)CC(F)F

DOS

IR

Vibrations