cyclopenta-1,3-diene; 2,3-di(cyclopenta-2,4-dien-1-yl)cycloprop-2-en-1-one; iron

Systemtic Name: cyclopenta-1,3-diene; 2,3-di(cyclopenta-2,4-dien-1-yl)cycloprop-2-en-1-one; iron Openeye Name: cyclopenta-1,3-diene; 2,3-di(cyclopenta-2,4-dien-1-yl)cycloprop-2-en-1-one; iron CAS Name: 2,3-bis(1-cyclopenta-2,4-dienyl)-1-cycloprop-2-enone; cyclopenta-1,3-diene; iron IUPAC Name: cyclopenta-1,3-diene; 2,3-di(cyclopenta-2,4-dien-1-yl)cycloprop-2-en-1-one; iron Traditional Name: cyclopenta-1,3-diene; 2,3-di(cyclopenta-2,4-dien-1-yl)cycloprop-2-en-1-one; iron Formula: C23H18Fe2O-4 MolecularWeight: 422.07842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=C[C-](C=C1)C2=C(C2=O)[C-]3C=CC=C3.[Fe].[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=C[C-](C=C1)C2=C(C2=O)[C-]3C=CC=C3.[Fe].[Fe]

InChI

InChI=1S/C13H8O.2C5H5.2Fe/c14-13-11(9-5-1-2-6-9)12(13)10-7-3-4-8-10;2*1-2-4-5-3-1;;/h1-8H;2*1-5H;;/q-2;2*-1;;