oxidanium; 1,3-diphenylpropane-1,3-dione; neodymium(3+)

Systemtic Name: oxidanium; 1,3-diphenylpropane-1,3-dione; neodymium(3+) Openeye Name: oxonium; 1,3-diphenylpropane-1,3-dione; neodymium(3+) CAS Name: oxonium; 1,3-diphenylpropane-1,3-dione; neodymium(3+) IUPAC Name: oxidanium; 1,3-diphenylpropane-1,3-dione; neodymium(3+) Traditional Name: oxonium; 1,3-diphenylpropane-1,3-dione; neodymium(3+) Formula: C45H36NdO7+ MolecularWeight: 833.00314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.[OH3+].[Nd+3]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[CH-]C(=O)C2=CC=CC=C2.[OH3+].[Nd+3]

InChI

InChI=1S/3C15H11O2.Nd.H2O/c3*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;;/h3*1-11H;;1H2/q3*-1;+3;/p+1