Geometry & MOs

Info

ID:	338468
PubChem CID:	127259160
Reduced:	ClINO3C23H31 (1)
Stoich.:	ABCD3E23F31 (1)
Weight, g/mol:	390.94722
ΔH_f, kcal/mol:	-123.55
Dipole, Da:	4.13
IP(EA), eV:	-8.71(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-7-iodoquinolin-8-yl)oxyethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCCCCCCCCCCCCOC1=C(C=C(C2=C1N=CC=C2)Cl)I

DOS

IR

Vibrations