cyclopenta-1,3-diene; (2-iodanylphenyl) 2-iodanylcyclopenta-2,4-diene-1-carboxylate; iron

Systemtic Name: cyclopenta-1,3-diene; (2-iodanylphenyl) 2-iodanylcyclopenta-2,4-diene-1-carboxylate; iron Openeye Name: cyclopenta-1,3-diene; (2-iodophenyl) 2-iodocyclopenta-2,4-diene-1-carboxylate; iron CAS Name: cyclopenta-1,3-diene; 2-iodo-1-cyclopenta-2,4-dienecarboxylic acid (2-iodophenyl) ester; iron IUPAC Name: cyclopenta-1,3-diene; (2-iodophenyl) 2-iodocyclopenta-2,4-diene-1-carboxylate; iron Traditional Name: cyclopenta-1,3-diene; 2-iodocyclopenta-2,4-diene-1-carboxylic acid (2-iodophenyl) ester; iron Formula: C17H12FeI2O2-2 MolecularWeight: 557.92992

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=CC=C(C(=C1)OC(=O)[C-]2C=CC=C2I)I.[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.C1=CC=C(C(=C1)OC(=O)[C-]2C=CC=C2I)I.[Fe]

InChI

InChI=1S/C12H7I2O2.C5H5.Fe/c13-9-6-3-4-8(9)12(15)16-11-7-2-1-5-10(11)14;1-2-4-5-3-1;/h1-7H;1-5H;/q2*-1;