Geometry & MOs

Info

ID:	327903
PubChem CID:	126691278
Reduced:	FN7H20C22 (1)
Stoich.:	AB7C20D22 (1)
Weight, g/mol:	373.153875
ΔH_f, kcal/mol:	118.18
Dipole, Da:	3.57
IP(EA), eV:	-9.74(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,4R)-2-methyloxan-4-yl]-2-(1,3-oxazol-5-ylmethyl)imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

C1CC1C2=CN(N=N2)CC3=NC4=CN=C5C=CC(=CC5=C4N3C6CCC(C6)F)C#N

DOS

IR

Vibrations