methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenyl-silane; zirconium(4+); dichloride

Systemtic Name: methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenyl-silane; zirconium(4+); dichloride Openeye Name: methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenyl-silane; zirconium(4+); dichloride CAS Name: methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenylsilane; zirconium(4+); dichloride IUPAC Name: methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenylsilane; zirconium(4+); dichloride Traditional Name: methyl-bis(2-methyl-8-phenyl-3,8-dihydroazulen-3-id-1-yl)-phenyl-silane; zirconium(4+); dichloride Formula: C41H36Cl2SiZr MolecularWeight: 718.94004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C([CH-]1)C=CC=CC2C3=CC=CC=C3)[Si](C)(C4=CC=CC=C4)C5=C([CH-]C6=C5C(C=CC=C6)C7=CC=CC=C7)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C([CH-]1)C=CC=CC2C3=CC=CC=C3)[Si](C)(C4=CC=CC=C4)C5=C([CH-]C6=C5C(C=CC=C6)C7=CC=CC=C7)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C41H36Si.2ClH.Zr/c1-29-27-33-21-13-15-25-36(31-17-7-4-8-18-31)38(33)40(29)42(3,35-23-11-6-12-24-35)41-30(2)28-34-22-14-16-26-37(39(34)41)32-19-9-5-10-20-32;;;/h4-28,36-37H,1-3H3;2*1H;/q-2;;;+4/p-2