Geometry & MOs

Info

ID:	52190
PubChem CID:	12014992
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-136.79
Dipole, Da:	1.04
IP(EA), eV:	-8.55(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-(2-methylquinolin-8-yl)oxyprop-2-enoate

Drug info:

PubChemData

Smile

CCOC(COC1=CC=CC2=C1N=C(C=C2)C)C(=O)OCC

DOS

IR

Vibrations