cyclohepta-1,3,5-triene stiborate hexahydrochloride

Systemtic Name: cyclohepta-1,3,5-triene stiborate hexahydrochloride Openeye Name: cyclohepta-1,3,5-triene stiborate hexahydrochloride CAS Name: cyclohepta-1,3,5-triene stiborate hexahydrochloride IUPAC Name: cyclohepta-1,3,5-triene stiborate hexahydrochloride Traditional Name: cyclohepta-1,3,5-triene stiborate hexahydrochloride Formula: C21H27Cl6O4Sb MolecularWeight: 677.91468

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=CC=[C+]1.C1C=CC=CC=[C+]1.C1C=CC=CC=[C+]1.[O-][Sb](=O)([O-])[O-].Cl.Cl.Cl.Cl.Cl.Cl

Isomeric SMILES

C1C=CC=CC=[C+]1.C1C=CC=CC=[C+]1.C1C=CC=CC=[C+]1.[O-][Sb](=O)([O-])[O-].Cl.Cl.Cl.Cl.Cl.Cl

InChI

InChI=1S/3C7H7.6ClH.4O.Sb/c3*1-2-4-6-7-5-3-1;;;;;;;;;;;/h3*1-5H,6H2;6*1H;;;;;/q3*+1;;;;;;;;3*-1;