2-ethynyl-1,3,4,5-tetramethyl-cyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene

Systemtic Name: 2-ethynyl-1,3,4,5-tetramethyl-cyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene Openeye Name: 2-ethynyl-1,3,4,5-tetramethyl-cyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene CAS Name: 2-ethynyl-1,3,4,5-tetramethylcyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene IUPAC Name: 2-ethynyl-1,3,4,5-tetramethylcyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene Traditional Name: 2-ethynyl-1,3,4,5-tetramethyl-cyclopenta-1,3-diene; iron; 1,2,4,5-tetramethylcyclopenta-1,3-diene Formula: C20H26Fe-2 MolecularWeight: 322.26544

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C(=CC(=C1C)C)C.C[C-]1C(=C(C(=C1C)C#C)C)C.[Fe]

Isomeric SMILES

C[C-]1C(=CC(=C1C)C)C.C[C-]1C(=C(C(=C1C)C#C)C)C.[Fe]

InChI

InChI=1S/C11H13.C9H13.Fe/c1-6-11-9(4)7(2)8(3)10(11)5;1-6-5-7(2)9(4)8(6)3;/h1H,2-5H3;5H,1-4H3;/q2*-1;