cyclopenta-1,3-diene; iron(2+); (3E)-penta-1,3-diene

Systemtic Name: cyclopenta-1,3-diene; iron(2+); (3E)-penta-1,3-diene Openeye Name: ferrous; cyclopenta-1,3-diene; (3E)-penta-1,3-diene CAS Name: cyclopenta-1,3-diene; iron(2+); (3E)-penta-1,3-diene IUPAC Name: cyclopenta-1,3-diene; iron(2+); (3E)-penta-1,3-diene Traditional Name: ferrous; cyclopenta-1,3-diene; (3E)-penta-1,3-diene Formula: C10H12Fe MolecularWeight: 188.04728

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=[CH-].C1C=CC=[C-]1.[Fe+2]

Isomeric SMILES

C/C=C/C=[CH-].C1C=CC=[C-]1.[Fe+2]

InChI

InChI=1S/C5H5.C5H7.Fe/c1-2-4-5-3-1;1-3-5-4-2;/h1-3H,4H2;1,3-5H,2H3;/q2*-1;+2/b;5-4+;