Geometry & MOs

Info

ID:	80548
PubChem CID:	49835077
Reduced:	O2N7C25H27 (1)
Stoich.:	A2B7C25D27 (1)
Weight, g/mol:	416.159689
ΔH_f, kcal/mol:	33.05
Dipole, Da:	4.83
IP(EA), eV:	-8.23(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3,4-dimethoxyphenyl)-1-(1,3-dimethylpyrazol-4-yl)-3H-imidazo[4,5-c][1,5]naphthyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)N2C3=C4C=C(C=CC4=NC=C3N(C2=O)C)C5=CC(=C(N=C5)NC)COC

DOS

IR

Vibrations