Geometry & MOs

Info

ID:	163416
PubChem CID:	57939330
Reduced:	O2N3H17C18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	407.01824
ΔH_f, kcal/mol:	-0.73
Dipole, Da:	3.76
IP(EA), eV:	-8.89(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-fluorophenyl)-7-iodo-8-propan-2-yloxyquinoline

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1N=C(C=C2)C(=O)NCCC3=CC=CC=N3

DOS

IR

Vibrations