1,10-phenanthrolin-10-ium; 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: 1,10-phenanthrolin-10-ium; 2,2,2-tris(chloranyl)ethanoate Openeye Name: 1,10-phenanthrolin-10-ium; 2,2,2-trichloroacetate CAS Name: 1,10-phenanthrolin-10-ium; 2,2,2-trichloroacetate IUPAC Name: 1,10-phenanthrolin-10-ium; 2,2,2-trichloroacetate Traditional Name: 1,10-phenanthrolin-10-ium; 2,2,2-trichloroacetate Formula: C14H9Cl3N2O2 MolecularWeight: 343.59246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2.C2HCl3O2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3-2(4,5)1(6)7/h1-8H;(H,6,7)