bis(2-ethyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride

Systemtic Name: bis(2-ethyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride Openeye Name: bis(2-ethyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride CAS Name: bis(2-ethyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-diphenylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-ethyl-3H-cyclopenta[a]naphthalen-3-id-1-yl)-diphenylsilane; zirconium(4+); dichloride Traditional Name: bis(2-ethyl-3H-benz[e]inden-3-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride Formula: C42H34Cl2SiZr MolecularWeight: 728.93486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C([CH-]1)C=CC3=CC=CC=C32)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C([CH-]C7=C6C8=CC=CC=C8C=C7)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC1=C(C2=C([CH-]1)C=CC3=CC=CC=C32)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C([CH-]C7=C6C8=CC=CC=C8C=C7)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C42H34Si.2ClH.Zr/c1-3-29-27-33-25-23-31-15-11-13-21-37(31)39(33)41(29)43(35-17-7-5-8-18-35,36-19-9-6-10-20-36)42-30(4-2)28-34-26-24-32-16-12-14-22-38(32)40(34)42;;;/h5-28H,3-4H2,1-2H3;2*1H;/q-2;;;+4/p-2