Geometry & MOs

Info

ID:	380963
PubChem CID:	134971575
Reduced:	O7C17H20 (1)
Stoich.:	A7B17C20 (1)
Weight, g/mol:	459.07163
ΔH_f, kcal/mol:	-284.91
Dipole, Da:	3.16
IP(EA), eV:	-10.28(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;copper;diethyl 2-[(4-ethoxycarbonylphenyl)-hydroxymethylidene]propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)C(=O)C(C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations