2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-[(E)-but-1-enyl]cyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C18H22Cl2Zr-2 MolecularWeight: 400.49728

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=[C-]CC=C1.CCC=CC1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC/C=C/C1=[C-]CC=C1.CC/C=C/C1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C9H11.2ClH.Zr/c2*1-2-3-6-9-7-4-5-8-9;;;/h2*3-4,6-7H,2,5H2,1H3;2*1H;/q2*-1;;;+2/p-2/b2*6-3+;;;