Geometry & MOs

Info

ID:	45763
PubChem CID:	10517393
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	287.05132
ΔH_f, kcal/mol:	-78.51
Dipole, Da:	4.43
IP(EA), eV:	-8.4(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-fluoro-2-(2-methoxyphenyl)quinoline

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CNCCC2=CC=C(C=C2)O)OC

DOS

IR

Vibrations