2-cyclopentylethynylbenzene; iron

Systemtic Name: 2-cyclopentylethynylbenzene; iron Openeye Name: 2-cyclopentylethynylbenzene; iron CAS Name: 2-cyclopentylethynylbenzene; iron IUPAC Name: 2-cyclopentylethynylbenzene; iron Traditional Name: 2-cyclopentylethynylbenzene; iron Formula: C26H18Fe MolecularWeight: 386.26612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#C[C]2[CH][CH][CH][CH]2.C1=CC=C(C=C1)C#C[C]2[CH][CH][CH][CH]2.[Fe]

Isomeric SMILES

C1=CC=C(C=C1)C#C[C]2[CH][CH][CH][CH]2.C1=CC=C(C=C1)C#C[C]2[CH][CH][CH][CH]2.[Fe]

InChI

InChI=1S/2C13H9.Fe/c2*1-2-6-12(7-3-1)10-11-13-8-4-5-9-13;/h2*1-9H;