Geometry & MOs

Info

ID:	321632
PubChem CID:	126666704
Reduced:	O2N6C21H24 (1)
Stoich.:	A2B6C21D24 (1)
Weight, g/mol:	390.12628
ΔH_f, kcal/mol:	25.76
Dipole, Da:	2.29
IP(EA), eV:	-9.32(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-yl]methyl]imidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

CC(C)(C1=CN(N=N1)CC2=NC3=C(N2C4CCOCC4)C5=CC=CC=C5N=C3)O

DOS

IR

Vibrations