1-tert-butyl-5-propan-2-ylidene-cyclopenta-1,3-diene; hydride; iron(3+); methanal

Systemtic Name: 1-tert-butyl-5-propan-2-ylidene-cyclopenta-1,3-diene; hydride; iron(3+); methanal Openeye Name: ferric; 1-tert-butyl-5-isopropylidene-cyclopenta-1,3-diene; formaldehyde; hydride CAS Name: 1-tert-butyl-5-propan-2-ylidenecyclopenta-1,3-diene; formaldehyde; hydride; iron(3+) IUPAC Name: 1-tert-butyl-5-propan-2-ylidenecyclopenta-1,3-diene; formaldehyde; hydride; iron(3+) Traditional Name: ferric; 1-tert-butyl-5-isopropylidene-cyclopenta-1,3-diene; formaldehyde; hydride Formula: C13H23FeO MolecularWeight: 251.16612

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Descriptors Computed from Structure

Canonical SMILES:

[H-].[H-].[H-].CC(=C1C=CC=C1C(C)(C)C)C.C=O.[Fe+3]

Isomeric SMILES

[H-].[H-].[H-].CC(=C1C=CC=C1C(C)(C)C)C.C=O.[Fe+3]

InChI

InChI=1S/C12H18.CH2O.Fe.3H/c1-9(2)10-7-6-8-11(10)12(3,4)5;1-2;;;;/h6-8H,1-5H3;1H2;;;;/q;;+3;3*-1