cyclopenta-1,3-diene; iron(2+); 3,5,6,7-tetrahydroinden-3-id-4-one

Systemtic Name: cyclopenta-1,3-diene; iron(2+); 3,5,6,7-tetrahydroinden-3-id-4-one Openeye Name: ferrous; cyclopenta-1,3-diene; 3,5,6,7-tetrahydroinden-3-id-4-one CAS Name: cyclopenta-1,3-diene; iron(2+); 3,5,6,7-tetrahydroinden-3-id-4-one IUPAC Name: cyclopenta-1,3-diene; iron(2+); 3,5,6,7-tetrahydroinden-3-id-4-one Traditional Name: ferrous; cyclopenta-1,3-diene; 3,5,6,7-tetrahydroinden-3-id-4-one Formula: C14H14FeO MolecularWeight: 254.10536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C([CH-]C=C2)C(=O)C1.[CH-]1C=CC=C1.[Fe+2]

Isomeric SMILES

C1CC2=C([CH-]C=C2)C(=O)C1.[CH-]1C=CC=C1.[Fe+2]

InChI

InChI=1S/C9H9O.C5H5.Fe/c10-9-6-2-4-7-3-1-5-8(7)9;1-2-4-5-3-1;/h1,3,5H,2,4,6H2;1-5H;/q2*-1;+2