cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; propan-2-ylidenezirconium(2+); dichloride

Systemtic Name: cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; propan-2-ylidenezirconium(2+); dichloride Openeye Name: cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; isopropylidenezirconium(2+); dichloride CAS Name: cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; propan-2-ylidenezirconium(2+); dichloride IUPAC Name: cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; propan-2-ylidenezirconium(2+); dichloride Traditional Name: cyclopenta-1,3-diene; 3,5-dihydrocyclopenta[c]phenanthren-3-ide; isopropylidenezirconium(2+); dichloride Formula: C25H22Cl2Zr-2 MolecularWeight: 484.57218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=[Zr+2])C.C1C=CC=[C-]1.C1C=C2[C-]=CC=C2C3=C1C=CC4=CC=CC=C43.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Zr+2])C.C1C=CC=[C-]1.C1C=C2[C-]=CC=C2C3=C1C=CC4=CC=CC=C43.[Cl-].[Cl-]

InChI

InChI=1S/C17H11.C5H5.C3H6.2ClH.Zr/c1-2-6-15-12(4-1)8-10-14-11-9-13-5-3-7-16(13)17(14)15;1-2-4-5-3-1;1-3-2;;;/h1-4,6-10H,11H2;1-3H,4H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2