2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride

Systemtic Name: 2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 2,5-diethylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C22H22Cl2Zr-2 MolecularWeight: 448.54008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C=CC(=[C-]1)CC.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1C=CC(=[C-]1)CC.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C13H9.C9H13.2ClH.Zr/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-8-5-6-9(4-2)7-8;;;/h1-5,7-8H,9H2;5-6,8H,3-4H2,1-2H3;2*1H;/q2*-1;;;+2/p-2