Geometry & MOs

Info

ID:	293292
PubChem CID:	117382660
Reduced:	ClNO2C13H14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	251.071306
ΔH_f, kcal/mol:	-57.81
Dipole, Da:	5.18
IP(EA), eV:	-9.12(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-2-methoxyquinolin-6-yl)propan-2-ol

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1Cl)C2(CCCC2)N=C=O

DOS

IR

Vibrations