lanthanum(3+); 2-oxidanylpropane-1,2,3-tricarboxylate; trichloride

Systemtic Name: lanthanum(3+); 2-oxidanylpropane-1,2,3-tricarboxylate; trichloride Openeye Name: lanthanum(3+) trichloride tricitrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; lanthanum(3+); trichloride IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; lanthanum(3+); trichloride Traditional Name: lanthanum(3+) trichloride tricitrate Formula: C18H15Cl3La4O21 MolecularWeight: 1229.2801

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Cl-].[Cl-].[Cl-].[La+3].[La+3].[La+3].[La+3]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Cl-].[Cl-].[Cl-].[La+3].[La+3].[La+3].[La+3]

InChI

InChI=1S/3C6H8O7.3ClH.4La/c3*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;/h3*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);3*1H;;;;/q;;;;;;4*+3/p-12