cyclopenta-1,3-diene; methane; methylidenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene

Systemtic Name: cyclopenta-1,3-diene; methane; methylidenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene Openeye Name: cyclopenta-1,3-diene; methane; methylenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene CAS Name: cyclopenta-1,3-diene; methane; methylenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene IUPAC Name: cyclopenta-1,3-diene; methane; methylidenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene Traditional Name: cyclopenta-1,3-diene; methane; methylenezirconium(2+); 1,2,3,5-tetramethylcyclopenta-1,3-diene Formula: C16H24Zr MolecularWeight: 307.58576

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Descriptors Computed from Structure

Canonical SMILES:

C.CC1[C-]=C(C(=C1C)C)C.C=[Zr+2].C1C=CC=[C-]1

Isomeric SMILES

C.CC1[C-]=C(C(=C1C)C)C.C=[Zr+2].C1C=CC=[C-]1

InChI

InChI=1S/C9H13.C5H5.CH4.CH2.Zr/c1-6-5-7(2)9(4)8(6)3;1-2-4-5-3-1;;;/h6H,1-4H3;1-3H,4H2;1H4;1H2;/q2*-1;;;+2