2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; zirconium(3+); dichloride

Systemtic Name: 2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; zirconium(3+); dichloride Openeye Name: 2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; zirconium(3+); dichloride CAS Name: 2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(3+); dichloride IUPAC Name: 2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(3+); dichloride Traditional Name: 2-tert-butylpyrrol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; zirconium(3+); dichloride Formula: C18H26Cl2NZr-2 MolecularWeight: 418.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)[CH2-].CC(C)(C)C1=CC=C[N-]1.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)[CH2-].CC(C)(C)C1=CC=C[N-]1.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C10H14.C8H12N.2ClH.Zr/c1-7-6-10(4,5)9(3)8(7)2;1-8(2,3)7-5-4-6-9-7;;;/h4H2,1-3,5H3;4-6H,1-3H3;2*1H;/q-2;-1;;;+3/p-2