1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride

Systemtic Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride Openeye Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride CAS Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride IUPAC Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride Traditional Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; phenol; zirconium; dichloride Formula: C16H21Cl2OZr-3 MolecularWeight: 391.46734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=C(C=C1)O.[Cl-].[Cl-].[Zr]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)C.C1=CC=C(C=C1)O.[Cl-].[Cl-].[Zr]

InChI

InChI=1S/C10H15.C6H6O.2ClH.Zr/c1-7-6-10(4,5)9(3)8(7)2;7-6-4-2-1-3-5-6;;;/h1-5H3;1-5,7H;2*1H;/q-1;;;;/p-2