2-butylcyclopenta-1,3-diene; iron(2+); propane

Systemtic Name: 2-butylcyclopenta-1,3-diene; iron(2+); propane Openeye Name: diferrous; 2-butylcyclopenta-1,3-diene; propane CAS Name: 2-butylcyclopenta-1,3-diene; iron(2+); propane IUPAC Name: 2-butylcyclopenta-1,3-diene; iron(2+); propane Traditional Name: diferrous; 2-butylcyclopenta-1,3-diene; propane Formula: C21H33Fe2+ MolecularWeight: 397.17672

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Descriptors Computed from Structure

Canonical SMILES:

CC[CH2-].CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[Fe+2].[Fe+2]

Isomeric SMILES

CC[CH2-].CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[Fe+2].[Fe+2]

InChI

InChI=1S/2C9H13.C3H7.2Fe/c2*1-2-3-6-9-7-4-5-8-9;1-3-2;;/h2*4,7H,2-3,5-6H2,1H3;1,3H2,2H3;;/q3*-1;2*+2