Geometry & MOs

Info

ID:	321680
PubChem CID:	126666787
Reduced:	F3O3N7C23H24 (1)
Stoich.:	A3B3C7D23E24 (1)
Weight, g/mol:	422.150954
ΔH_f, kcal/mol:	-140.51
Dipole, Da:	7.44
IP(EA), eV:	-8.97(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-chloro-1-[(2R,4R)-2-methyloxan-4-yl]imidazo[4,5-c]quinolin-2-yl]-(5-methylpyridin-2-yl)methanol

Drug info:

PubChemData

Smile

C1[C@@H](CN([C@H]1C2=C(C=CC(=C2)F)F)C(=O)C3=C4C(=NN3)N=CN=C4NC5CN(C[C@H]5O)C6COC6)F

DOS

IR

Vibrations