cyclopenta-1,3-diene; 1-[(S)-cyclopenta-1,3-dien-1-ylsulfinyl]-4-methyl-benzene; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; 1-[(S)-cyclopenta-1,3-dien-1-ylsulfinyl]-4-methyl-benzene; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; 1-[(S)-cyclopenta-1,3-dien-1-ylsulfinyl]-4-methyl-benzene CAS Name: cyclopenta-1,3-diene; 1-[(S)-1-cyclopenta-1,3-dienylsulfinyl]-4-methylbenzene; iron(2+) IUPAC Name: cyclopenta-1,3-diene; 1-[(S)-cyclopenta-1,3-dien-1-ylsulfinyl]-4-methylbenzene; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; 1-[(S)-cyclopenta-1,3-dien-1-ylsulfinyl]-4-methyl-benzene Formula: C17H16FeOS MolecularWeight: 324.21834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C2=CC=C[CH-]2.[CH-]1C=CC=C1.[Fe+2]

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)C2=CC=C[CH-]2.[CH-]1C=CC=C1.[Fe+2]

InChI

InChI=1S/C12H11OS.C5H5.Fe/c1-10-6-8-12(9-7-10)14(13)11-4-2-3-5-11;1-2-4-5-3-1;/h2-9H,1H3;1-5H;/q2*-1;+2/t14-;;/m0../s1