dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride

Systemtic Name: dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride Openeye Name: dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride CAS Name: dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride IUPAC Name: dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride Traditional Name: dimethyl-bis(2-methyl-8-phenyl-3H-azulen-3-id-1-yl)silane; zirconium(4+); dichloride Formula: C36H30Cl2SiZr MolecularWeight: 652.8389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=CC2=[C-]1)C3=CC=CC=C3)[Si](C)(C)C4=C([C-]=C5C4=C(C=CC=C5)C6=CC=CC=C6)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C(C=CC=CC2=[C-]1)C3=CC=CC=C3)[Si](C)(C)C4=C([C-]=C5C4=C(C=CC=C5)C6=CC=CC=C6)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C36H30Si.2ClH.Zr/c1-25-23-29-19-11-13-21-31(27-15-7-5-8-16-27)33(29)35(25)37(3,4)36-26(2)24-30-20-12-14-22-32(34(30)36)28-17-9-6-10-18-28;;;/h5-22H,1-4H3;2*1H;/q-2;;;+4/p-2