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

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; cyclopenta-1,3-diene; iron(2+) Openeye Name: ferrous; 2-tert-butylcyclopenta-1,3-diene; cyclopenta-1,3-diene CAS Name: 2-tert-butylcyclopenta-1,3-diene; cyclopenta-1,3-diene; iron(2+) IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; cyclopenta-1,3-diene; iron(2+) Traditional Name: ferrous; 2-tert-butylcyclopenta-1,3-diene; cyclopenta-1,3-diene Formula: C14H18Fe MolecularWeight: 242.13772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=[C-]CC=C1.C1C=CC=[C-]1.[Fe+2]

Isomeric SMILES

CC(C)(C)C1=[C-]CC=C1.C1C=CC=[C-]1.[Fe+2]

InChI

InChI=1S/C9H13.C5H5.Fe/c1-9(2,3)8-6-4-5-7-8;1-2-4-5-3-1;/h4,6H,5H2,1-3H3;1-3H,4H2;/q2*-1;+2