cyclopenta-1,3-diene; iron(3+); 1,3,5-trimethylbenzene; dichloride

Systemtic Name: cyclopenta-1,3-diene; iron(3+); 1,3,5-trimethylbenzene; dichloride Openeye Name: ferric; cyclopenta-1,3-diene; mesitylene; dichloride CAS Name: cyclopenta-1,3-diene; iron(3+); 1,3,5-trimethylbenzene; dichloride IUPAC Name: cyclopenta-1,3-diene; iron(3+); 1,3,5-trimethylbenzene; dichloride Traditional Name: ferric; cyclopenta-1,3-diene; mesitylene; dichloride Formula: C14H17Cl2Fe MolecularWeight: 312.03578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C)C.C1C=CC=[C-]1.[Cl-].[Cl-].[Fe+3]

Isomeric SMILES

CC1=CC(=CC(=C1)C)C.C1C=CC=[C-]1.[Cl-].[Cl-].[Fe+3]

InChI

InChI=1S/C9H12.C5H5.2ClH.Fe/c1-7-4-8(2)6-9(3)5-7;1-2-4-5-3-1;;;/h4-6H,1-3H3;1-3H,4H2;2*1H;/q;-1;;;+3/p-2