carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride

Systemtic Name: carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride Openeye Name: carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride CAS Name: carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride IUPAC Name: carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride Traditional Name: carbanide; 2-ethyl-4-phenyl-1,4-dihydroazulen-1-ide; silicon; zirconium(4+); dichloride Formula: C38H40Cl2SiZr-2 MolecularWeight: 686.9397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CCC1=CC2=C([CH-]1)C=CC=CC2C3=CC=CC=C3.CCC1=CC2=C([CH-]1)C=CC=CC2C3=CC=CC=C3.[Si].[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH3-].[CH3-].CCC1=CC2=C([CH-]1)C=CC=CC2C3=CC=CC=C3.CCC1=CC2=C([CH-]1)C=CC=CC2C3=CC=CC=C3.[Si].[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C18H17.2CH3.2ClH.Si.Zr/c2*1-2-14-12-16-10-6-7-11-17(18(16)13-14)15-8-4-3-5-9-15;;;;;;/h2*3-13,17H,2H2,1H3;2*1H3;2*1H;;/q4*-1;;;;+4/p-2