methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+)

Systemtic Name: methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+) Openeye Name: methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+) CAS Name: methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+) IUPAC Name: methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+) Traditional Name: methanidylbenzene; 2-methylcyclopenta-1,3-diene; titanium(4+) Formula: C27H28Ti MolecularWeight: 400.37822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Ti+4]

Isomeric SMILES

CC1=[C-]CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Ti+4]

InChI

InChI=1S/3C7H7.C6H7.Ti/c3*1-7-5-3-2-4-6-7;1-6-4-2-3-5-6;/h3*2-6H,1H2;2,4H,3H2,1H3;/q4*-1;+4