2,5-ditert-butylcyclopenta-1,3-diene; iron(2+); methanal

Systemtic Name: 2,5-ditert-butylcyclopenta-1,3-diene; iron(2+); methanal Openeye Name: ferrous; 2,5-ditert-butylcyclopenta-1,3-diene; formaldehyde CAS Name: 2,5-ditert-butylcyclopenta-1,3-diene; formaldehyde; iron(2+) IUPAC Name: 2,5-ditert-butylcyclopenta-1,3-diene; formaldehyde; iron(2+) Traditional Name: ferrous; 2,5-ditert-butylcyclopenta-1,3-diene; formaldehyde Formula: C16H27FeO3+ MolecularWeight: 323.22878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21.3CH2O.Fe/c1-12(2,3)10-7-8-11(9-10)13(4,5)6;3*1-2;/h7-8,10H,1-6H3;3*1H2;/q-1;;;;+2