Geometry & MOs

Info

ID:	321640
PubChem CID:	126666715
Reduced:	ClOSN5C20H20 (1)
Stoich.:	ABCD5E20F20 (1)
Weight, g/mol:	382.126361
ΔH_f, kcal/mol:	35.5
Dipole, Da:	4.86
IP(EA), eV:	-8.36(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[8-fluoro-1-[(2S,4S)-2-methyloxan-4-yl]imidazo[4,5-c]quinolin-2-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CCO1)N2C(=NC3=C2C4=C(C=CC(=C4)Cl)N=C3N)CC5=CSC=N5

DOS

IR

Vibrations