Geometry & MOs

Info

ID:	321717
PubChem CID:	126666852
Reduced:	F2O3N6C19H22 (1)
Stoich.:	A2B3C6D19E22 (1)
Weight, g/mol:	434.152495
ΔH_f, kcal/mol:	-130.69
Dipole, Da:	7.58
IP(EA), eV:	-9.05(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[8-methoxy-1-[(2R,4R)-2-methyloxan-4-yl]imidazo[4,5-c]quinolin-2-yl]methyl]imidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

C[C@H](C1CC(=CC=C1F)F)NC(=O)C2=C3C(=NN2)N=CN=C3N[C@@H]4COCC[C@H]4O

DOS

IR

Vibrations