cyclopenta-1,3-diene; iron(2+); propan-2-ylbenzene

Systemtic Name: cyclopenta-1,3-diene; iron(2+); propan-2-ylbenzene Openeye Name: ferrous; cyclopenta-1,3-diene; isopropylbenzene CAS Name: cyclopenta-1,3-diene; iron(2+); propan-2-ylbenzene IUPAC Name: cyclopenta-1,3-diene; iron(2+); propan-2-ylbenzene Traditional Name: ferrous; cyclopenta-1,3-diene; isopropylbenzene Formula: C14H16Fe MolecularWeight: 240.12184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C[C-]=CC=C1.C1C=CC=[C-]1.[Fe+2]

Isomeric SMILES

CC(C)C1=C[C-]=CC=C1.C1C=CC=[C-]1.[Fe+2]

InChI

InChI=1S/C9H11.C5H5.Fe/c1-8(2)9-6-4-3-5-7-9;1-2-4-5-3-1;/h3-4,6-8H,1-2H3;1-3H,4H2;/q2*-1;+2