Geometry & MOs

Info

ID:	167904
PubChem CID:	74893268
Reduced:	ON3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	302.126657
ΔH_f, kcal/mol:	63.54
Dipole, Da:	12.03
IP(EA), eV:	-9.15(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-4-oxo-N-(oxolan-2-ylmethyl)-3H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)NC2=CC3=NC(=O)N=C3C=C2

DOS

IR

Vibrations