Geometry & MOs

Info

ID:	179859
PubChem CID:	76545104
Reduced:	ZnO2C5H7 (1)
Stoich.:	AB2C5D7 (1)
Weight, g/mol:	512.334918
ΔH_f, kcal/mol:	-29.54
Dipole, Da:	1.88
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.753530
Charge, e:	0

Chem-info

IUPAC name:

7-(carboxymethyl)tricos-8-ene-1,8,23-tricarboxylic acid

Drug info:

PubChemData

Smile

CC=C(C)C(=O)[O-].[Zn]

DOS

IR

Vibrations