Geometry & MOs

Info

ID:	180661
PubChem CID:	76665426
Reduced:	O2N6C21H24 (1)
Stoich.:	A2B6C21D24 (1)
Weight, g/mol:	383.149458
ΔH_f, kcal/mol:	11.1
Dipole, Da:	10.03
IP(EA), eV:	-8.32(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(1H-indazol-6-ylamino)-6-[6-(methylamino)pyridin-3-yl]-8aH-2,7-naphthyridin-1-one

Drug info:

PubChemData

Smile

COC1=NC=C(C=N1)C2CC3CCNC(=O)C3C(N2)NC4=CC5=C(CN=C5)C=C4

DOS

IR

Vibrations