cerium(3+); 1,10-phenanthroline; trichloride; hydrate

Systemtic Name: cerium(3+); 1,10-phenanthroline; trichloride; hydrate Openeye Name: cerium(3+); 1,10-phenanthroline; trichloride; hydrate CAS Name: cerium(3+); 1,10-phenanthroline; trichloride; hydrate IUPAC Name: cerium(3+); 1,10-phenanthroline; trichloride; hydrate Traditional Name: cerium(3+); 1,10-phenanthroline; trichloride; hydrate Formula: C24H18CeCl3N4O MolecularWeight: 624.90092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.O.[Cl-].[Cl-].[Cl-].[Ce+3]

Isomeric SMILES

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.O.[Cl-].[Cl-].[Cl-].[Ce+3]

InChI

InChI=1S/2C12H8N2.Ce.3ClH.H2O/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;;;;/h2*1-8H;;3*1H;1H2/q;;+3;;;;/p-3