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zirconocene
Sign in to saveAlso known as Cp2Zr
Zirconocene is a hypothetical compound with 14 valence electrons, which has not been observed or isolated. It is an organometallic compound consisting of two cyclopentadienyl rings bound on a central zirconium atom. A crucial question in research is what kind of ligands can be used to stabilize the Cp2ZrII metallocene fragment to make it available for further reactions in organic synthesis.
Chemical data
- Formula
- C10H10Zr
- Molecular weight
- 221.41 g/mol
- SMILES
- C1=C[CH]C=C1.C1=C[CH]C=C1.[Zr]
- InChIKey
- MSWIXEBCYIMCRZ-UHFFFAOYSA-N
- Polar surface area
- 0 Ų
- H-bond donors
- 0
- H-bond acceptors
- 0
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 219.982955
Show 2 more facts
- chemical formula
- C₁₀H₁₀Zr
- canonical SMILES
- C1=C[CH]C=C1.C1=C[CH]C=C1.[Zr]
Sources (1)
via Wikidata · CC0
~4 min read
Encyclopedic overview
6 sectionsContents
- Structure
- History
- Synthesis
- Reactions
- Applications
- References
Zirconocene is a hypothetical compound with 14 valence electrons, which has not been observed or isolated. It is an organometallic compound consisting of two cyclopentadienyl rings bound on a central zirconium atom. A crucial question in research is what kind of ligands can be used to stabilize the Cp2ZrII metallocene fragment to make it available for further reactions in organic synthesis.
== Structure == In contrast to sandwich compounds that have parallel cyclopentadienyl rings bound on opposite sides of the metal atom, such as ferrocene, zirconocene and other group 4 metallocenes are bent. Without stabilizing ligands, the Cp2ZrII fragment is unstable and dimerizes to form a fulvalene complex.
Excerpted from Wikipedia’s “zirconocene” article, available under the CC BY-SA 4.0 licence.