cyclopenta-1,3-diene; 1-cyclopenta-1,4-dien-1-yl-4-nitro-benzene; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; 1-cyclopenta-1,4-dien-1-yl-4-nitro-benzene; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; 1-cyclopenta-1,4-dien-1-yl-4-nitro-benzene CAS Name: cyclopenta-1,3-diene; 1-(1-cyclopenta-1,4-dienyl)-4-nitrobenzene; iron(2+) IUPAC Name: cyclopenta-1,3-diene; 1-cyclopenta-1,4-dien-1-yl-4-nitrobenzene; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; 1-cyclopenta-1,4-dien-1-yl-4-nitro-benzene Formula: C16H13FeNO2 MolecularWeight: 307.12492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8NO2.C5H5.Fe/c13-12(14)11-7-5-10(6-8-11)9-3-1-2-4-9;1-2-4-5-3-1;/h1-8H;1-5H;/q2*-1;+2