Geometry & MOs

Info

ID:	50201
PubChem CID:	12012712
Reduced:	IPO2C24H26 (1)
Stoich.:	ABC2D24E26 (1)
Weight, g/mol:	471.911439
ΔH_f, kcal/mol:	-54.62
Dipole, Da:	5.52
IP(EA), eV:	-7.99(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

calcium;dipotassium;1-(2-oxidonaphthalen-1-yl)naphthalen-2-olate;dichloride

Drug info:

PubChemData

Smile

CCCOC(=O)CCP(C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)I

DOS

IR

Vibrations