1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide

Systemtic Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide Openeye Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide CAS Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide IUPAC Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide Traditional Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(3+); triphenoxide Formula: C28H30O3Ti- MolecularWeight: 462.403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+3]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+3]

InChI

InChI=1S/C10H15.3C6H6O.Ti/c1-7-6-10(4,5)9(3)8(7)2;3*7-6-4-2-1-3-5-6;/h1-5H3;3*1-5,7H;/q-1;;;;+3/p-3