Geometry & MOs

Info

ID:	327809
PubChem CID:	126691094
Reduced:	O3N5C23H23 (1)
Stoich.:	A3B5C23D23 (1)
Weight, g/mol:	382.119654
ΔH_f, kcal/mol:	11.73
Dipole, Da:	3.43
IP(EA), eV:	-9.16(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[8-chloro-1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-yl]methyl]-5-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

C#CC(=O)N1CCC(C1)N=C(/C(=C(/C2=CC=C(C=C2)OC3=CC=CC=C3)\N)/C(=O)N)N

DOS

IR

Vibrations