Vanadocene

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Vanadocene
File:Vanadocen.svg
Names
IUPAC name
Vanadocene
Systematic IUPAC name
Bis(η5-cyclopentadienyl)vanadium
Identifiers
3D model (JSmol)
ChemSpider
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EC Number
  • 620-850-1
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UNII
  • {{#property:P3117}}Lua error in Module:EditAtWikidata at line 29: attempt to index field 'wikibase' (a nil value).
  • InChI=1S/2C5H5.V/c2*1-2-4-5-3-1;/h2*1-5H;/q2*-1;+2
    Key: YXQWGVLNDXNSJJ-UHFFFAOYSA-N
  • c1ccc[cH-]1.c2ccc[cH-]2.[V+2]
Properties
V(C5H5)2
Molar mass 181.128 g/mol
Appearance Violet crystals
Melting point 167 °C (333 °F; 440 K)
Hazards
GHS labelling:[1]
GHS02: FlammableGHS06: Toxic
Danger
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).

Vanadocene, bis(η5-cyclopentadienyl) vanadium, is the organometallic compound with the formula V(C5H5)2, commonly abbreviated Cp2V. It is a violet crystalline, paramagnetic solid. Vanadocene has relatively limited practical use, but it has been extensively studied.

Structure and bonding

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V(C5H5)2 is a metallocene, a class of organometallic compounds that typically have a metal ion sandwiched between two cyclopentadienyl rings. In the solid state, the molecule has D5d symmetry. The vanadium(II) center resides equidistant between the center of the two cyclopentadienyl rings at a crystallographic center of inversion. The average V-C bond distance is 226 pm.[1] The Cp rings of vanadocene are dynamically disordered at temperatures above 170 K and are only fully ordered at 108 K.

Preparation

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Vanadocene was first prepared in 1954 by Birmingham, Fischer, and Wilkinson via a reduction of vanadocene dichloride with aluminum hydride, after which vanadocene was sublimed in vacuum at 100 ˚C.[2] A modern synthesis of vanadocene that allows production in higher quantities requires treating [V2Cl3(THF)6]2[Zn2Cl6] with cyclopentadienylsodium.[3]

2 [V2Cl3(THF)6]2[Zn2Cl6] + 8 NaCp + THF → 4 Cp2V

Properties

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With only 15 valence electrons, vanadocene is highly reactive. For example,it adds alkynes to yield the corresponding vanadium-cyclopropene complexes.[4]

File:Vanadocene ethin reaction.svg

Likewise, high carbon monoxide pressures give CpV(CO)4.[5] That piano-stool complex can rearrange to an ionic, mixed-valence, vanadium hexacarbonyl derivative:[citation needed]

Cp2V + V(CO)6 → [Cp2V(CO)2]+[V(CO)6]

Vanadocene is extremely air-sensitive, and either 12% (by mass) hydrochloric acid[6] or ferrocenium in toluene will easily oxidize an electron from the complex:[7]

VCp2 + [FeCp2]BR4 → [VCp2]BR4 + FeCp2 (R = Ph or 4-C6H4F)

The monocations themselves oxidize in air, having a redox potential of -1.10 V.[7]

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  • (Cycloheptatrienyl)(cyclopentadienyl)vanadium (V(C5H5)(C7H7)

References

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  3. ^ Lorber, C. "Vanadium Organometallics." Chapter 5.01. Comprehensive Organometallic Chemistry III. Elsevier, 2007. 1-60.
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