Geometry & MOs

Info

ID:	80613
PubChem CID:	49835511
Reduced:	NO2H12C13 (2)
Stoich.:	AB2C12D13 (2)
Weight, g/mol:	476.16306
ΔH_f, kcal/mol:	-85.23
Dipole, Da:	4.68
IP(EA), eV:	-8.6(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(1,3-dimethylpyrazol-4-yl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-8-yl]-N,N-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(C2=C(C(=C1)C3=CC=CNC3=O)N=CC(=C2)C4=CC=CC=C4C(=O)O)OC

DOS

IR

Vibrations