Geometry & MOs

Info

ID:	80627
PubChem CID:	49835604
Reduced:	N11H15C17 (1)
Stoich.:	A11B15C17 (1)
Weight, g/mol:	463.152351
ΔH_f, kcal/mol:	200.14
Dipole, Da:	4.57
IP(EA), eV:	-8.13(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-1-methylpyrazol-4-yl)-8-[5-(ethylamino)-6-methoxypyridin-3-yl]-3-methylimidazo[4,5-c]quinolin-2-one

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N)C2=C(N=C3N2N=CC=C3)NC4=NN(C=C4)C5=NC=CN5

DOS

IR

Vibrations