Geometry & MOs

Info

ID:	13255
PubChem CID:	224414
Reduced:	ClNO4C14H14 (1)
Stoich.:	ABC4D14E14 (1)
Weight, g/mol:	295.061136
ΔH_f, kcal/mol:	-123.29
Dipole, Da:	3.6
IP(EA), eV:	-8.33(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-chloro-5,8-dimethoxyquinoline-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(C=CC(=C2N=C1)OC)OC)Cl

DOS

IR

Vibrations