digallium phthalate

Systemtic Name: digallium phthalate Openeye Name: digallium phthalate CAS Name: digallium phthalate IUPAC Name: digallium phthalate Traditional Name: digallium phthalate Formula: C24H12Ga2O12 MolecularWeight: 631.79088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Ga+3].[Ga+3]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Ga+3].[Ga+3]

InChI

InChI=1S/3C8H6O4.2Ga/c3*9-7(10)5-3-1-2-4-6(5)8(11)12;;/h3*1-4H,(H,9,10)(H,11,12);;/q;;;2*+3/p-6