Geometry & MOs

Info

ID:	321537
PubChem CID:	126666543
Reduced:	N5C15H17 (1)
Stoich.:	A5B15C17 (1)
Weight, g/mol:	301.09819
ΔH_f, kcal/mol:	83.77
Dipole, Da:	6.22
IP(EA), eV:	-8.81(-1.12)
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]quinoline

Drug info:

PubChemData

Smile

CN1CC[C@H](C1)NC2=C3C=C(C=CC3=NC=C2N)C#N

DOS

IR

Vibrations