Geometry & MOs

Info

ID:	32669
PubChem CID:	7847064
Reduced:	N3O4H21C22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	377.162708
ΔH_f, kcal/mol:	-81.7
Dipole, Da:	1.85
IP(EA), eV:	-9.25(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-ethoxyphenyl)-2-oxoethyl] 2-ethyl-3-methylquinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3

DOS

IR

Vibrations