Geometry & MOs

Info

ID:	436472
PubChem CID:	135203442
Reduced:	O2C13H24 (2)
Stoich.:	A2B13C24 (2)
Weight, g/mol:	408.087685
ΔH_f, kcal/mol:	-239.37
Dipole, Da:	5.51
IP(EA), eV:	-10.65(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorobenzoyl)-8-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxyquinolin-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCC(=C)C(=O)O.CC(=C)C(=O)OC

DOS

IR

Vibrations