(diphenylmethylidene)titanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride

Systemtic Name: (diphenylmethylidene)titanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride Openeye Name: benzhydrylidenetitanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride CAS Name: (diphenylmethylene)titanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride IUPAC Name: benzhydrylidenetitanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride Traditional Name: benzhydrylidenetitanium(2+); 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; dichloride Formula: C64H52Cl2Ti2-2 MolecularWeight: 987.73768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.CC1=[C-]CC=C1.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.C1=CC=C(C=C1)C(=[Ti+2])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Ti+2])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CC1=[C-]CC=C1.CC1=[C-]CC=C1.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.C1=CC=C(C=C1)C(=[Ti+2])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Ti+2])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/2C13H9.2C13H10.2C6H7.2ClH.2Ti/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;2*1-6-4-2-3-5-6;;;;/h2*1-9H;2*1-10H;2*2,4H,3H2,1H3;2*1H;;/q2*-1;;;2*-1;;;2*+2/p-2