Geometry & MOs

Info

ID:	327850
PubChem CID:	126691160
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	396.098918
ΔH_f, kcal/mol:	-103.54
Dipole, Da:	2.86
IP(EA), eV:	-8.94(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-chloro-1-[(2R)-2-methyloxan-4-yl]imidazo[4,5-c]quinolin-2-yl]-(1,2-oxazol-3-yl)methanone

Drug info:

PubChemData

Smile

CCCC(CC(=O)N)C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3NC1=O

DOS

IR

Vibrations