Geometry & MOs

Info

ID:	128280
PubChem CID:	51037452
Reduced:	FO2N4H13C16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	351.20591
ΔH_f, kcal/mol:	21.02
Dipole, Da:	4.69
IP(EA), eV:	-9.51(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)F)NC2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations