butane; methyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-phenyl-silane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide

Systemtic Name: butane; methyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-phenyl-silane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide Openeye Name: butane; methyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-phenyl-silane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide CAS Name: butane; methyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-phenylsilane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide IUPAC Name: butane; methyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-phenylsilane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide Traditional Name: butane; methyl-bis(2-methyl-3H-benz[e]inden-3-id-1-yl)-phenyl-silane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(4+); bromide Formula: C55H50BrSiTi- MolecularWeight: 866.842

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Descriptors Computed from Structure

Canonical SMILES:

CCC[CH2-].CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=C(C2=C([CH-]1)C=CC3=CC=CC=C32)[Si](C)(C4=CC=CC=C4)C5=C([CH-]C6=C5C7=CC=CC=C7C=C6)C.[Ti+4].[Br-]

Isomeric SMILES

CCC[CH2-].CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=C(C2=C([CH-]1)C=CC3=CC=CC=C32)[Si](C)(C4=CC=CC=C4)C5=C([CH-]C6=C5C7=CC=CC=C7C=C6)C.[Ti+4].[Br-]

InChI

InChI=1S/C35H28Si.C16H13.C4H9.BrH.Ti/c1-23-21-27-19-17-25-11-7-9-15-30(25)32(27)34(23)36(3,29-13-5-4-6-14-29)35-24(2)22-28-20-18-26-12-8-10-16-31(26)33(28)35;1-12-10-14-8-5-9-15(16(14)11-12)13-6-3-2-4-7-13;1-3-4-2;;/h4-22H,1-3H3;2-11H,1H3;1,3-4H2,2H3;1H;/q-2;2*-1;;+4/p-1