bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenyl-silane; titanium(2+)

Systemtic Name: bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenyl-silane; titanium(2+) Openeye Name: bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenyl-silane; titanium(2+) CAS Name: bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenylsilane; titanium(2+) IUPAC Name: bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenylsilane; titanium(2+) Traditional Name: bis(3-butyl-2-ethyl-3H-inden-1-yl)-diphenyl-silane; titanium(2+) Formula: C42H46SiTi MolecularWeight: 626.76714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2C1CCC[CH2-])[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=C(C(C6=CC=CC=C65)CCC[CH2-])CC.[Ti+2]

Isomeric SMILES

CCC1=C(C2=CC=CC=C2C1CCC[CH2-])[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=C(C(C6=CC=CC=C65)CCC[CH2-])CC.[Ti+2]

InChI

InChI=1S/C42H46Si.Ti/c1-5-9-25-35-33(7-3)41(39-29-19-17-27-37(35)39)43(31-21-13-11-14-22-31,32-23-15-12-16-24-32)42-34(8-4)36(26-10-6-2)38-28-18-20-30-40(38)42;/h11-24,27-30,35-36H,1-2,5-10,25-26H2,3-4H3;/q-2;+2