benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+)

Systemtic Name: benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Openeye Name: benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) CAS Name: benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) IUPAC Name: benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Traditional Name: benzene; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Formula: C32H40Zr MolecularWeight: 515.884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

InChI

InChI=1S/2C10H15.2C6H5.Zr/c2*1-7-6-10(4,5)9(3)8(7)2;2*1-2-4-6-5-3-1;/h2*1-5H3;2*1-5H;/q4*-1;+4