2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride

Systemtic Name: 2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride Openeye Name: 2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride CAS Name: 2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride IUPAC Name: 2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride Traditional Name: 2,4,6-trimethylcyclopenta[b]pyrrole; zirconium(2+); dichloride Formula: C20H22Cl2N2Zr MolecularWeight: 452.53208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C1=NC(=C2)C)C.CC1=CC(=C2C1=NC(=C2)C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1=CC(=C2C1=NC(=C2)C)C.CC1=CC(=C2C1=NC(=C2)C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C10H11N.2ClH.Zr/c2*1-6-4-7(2)10-9(6)5-8(3)11-10;;;/h2*4-5H,1-3H3;2*1H;/q;;;;+2/p-2