Geometry & MOs

Info

ID:	21992
PubChem CID:	594588
Reduced:	NOC8H9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	-44.83
Dipole, Da:	3.62
IP(EA), eV:	-8.1(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-methoxyquinolin-8-yl)amino]cyclohexan-1-one

Drug info:

PubChemData

Smile

COC1=CC(=C2C(=C1)C=CC=N2)NC3CCCCC3=O

DOS

IR

Vibrations