Geometry & MOs

Info

ID:	338469
PubChem CID:	127259161
Reduced:	ClINO3H11C13 (1)
Stoich.:	ABCD3E11F13 (1)
Weight, g/mol:	376.93157
ΔH_f, kcal/mol:	-71.56
Dipole, Da:	4.03
IP(EA), eV:	-8.81(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-7-iodoquinolin-8-yl)oxymethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCCOC1=C(C=C(C2=C1N=CC=C2)Cl)I

DOS

IR

Vibrations