Geometry & MOs

Info

ID:	321686
PubChem CID:	126666794
Reduced:	N5H11C15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	387.169525
ΔH_f, kcal/mol:	116.74
Dipole, Da:	4.06
IP(EA), eV:	-8.9(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C=N2)NC(=N3)CC4=NC=CN=C4

DOS

IR

Vibrations