Chemicals

Central atom: Zirconium
Title Central atom Valence Number (VN) = 𝘹 + 2𝘻 Coordination number Oxidation number Electron number Attached ligand taxonomy Compound type Geometry Formula Unicode
cis–[Zr(OPh)₃(Pc)]⊖ Zirconium VN: 4 CN: 7 ON: (IV) EN: 14 OPh (phenoxy), Pc (phthalocyaninato) Molecular 7-coordinate: trigonal prism, square-face monocapped (TPRS-7)

cis–[Zr(OPh)₃(Pc)]⊖
cis–[Zr(OPh){CO₂(OH)-κ²O}(Tpp)] Zirconium VN: 4 CN: 7 ON: (IV) EN: 14 OPh (phenoxy), CO₂(OH) (hydrogencarbonato-κ²O), Tpp (tetraphenylporphyrin) Molecular 7-coordinate: octahedron, face monocapped (OCF-7)

cis–[Zr(OPh){CO₂(OH)-κ²O}(Tpp)]
[Zr(OPrⁱ)(Acac)₃] Zirconium VN: 4 CN: 7 ON: (IV) EN: 14 OPrⁱ (isopropoxy), Acac (acetylacetonato) Molecular 7-coordinate: pentagonal bipyramid (PBPY-7)

[Zr(OPrⁱ)(Acac)₃]
[Zr(OPrⁱ)₂(μ₂-OPrⁱ)(Acac)]₂ Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 OPrⁱ (isopropoxy), OPrⁱ (μ₂-isopropoxy), Acac (acetylacetonato) Oligomer 6-coordinate: octahedron (OC-6)

[Zr(OPrⁱ)₂(μ₂-OPrⁱ)(Acac)]₂
[Zr(OPrⁱ)₃(μ₂-OPrⁱ)(NH₂Bz)]₂ Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 OPrⁱ (isopropoxy), OPrⁱ (μ₂-isopropoxy), NH₂Bz (benzylamine) Oligomer 6-coordinate: octahedron (OC-6)

[Zr(OPrⁱ)₃(μ₂-OPrⁱ)(NH₂Bz)]₂
[Zr(OPrⁱ)₃(μ₂-OPrⁱ)(OHPrⁱ)]₂ Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 OPrⁱ (isopropoxy), OPrⁱ (μ₂-isopropoxy), OHPrⁱ (isopropanol) Oligomer 6-coordinate: octahedron (OC-6)

[Zr(OPrⁱ)₃(μ₂-OPrⁱ)(OHPrⁱ)]₂
[Zr(OPrⁱ){OC(Buᵗ)CHC(Buᵗ)O}₃] Zirconium VN: 4 CN: 7 ON: (IV) EN: 14 OPrⁱ (isopropoxy), OC(Buᵗ)CHC(Buᵗ)O (tetramethylheptane-3,5-dionato) Molecular 7-coordinate: trigonal prism, square-face monocapped (TPRS-7)

[Zr(OPrⁱ){OC(Buᵗ)CHC(Buᵗ)O}₃]
[Zr(Ox)₄]⁴⊖ Zirconium VN: 4 CN: 8 ON: (IV) EN: 16 Ox (oxalato) Molecular 8-coordinate: trigonal prism, square-face bicapped (TPRS-8)

[Zr(Ox)₄]⁴⊖
[Zr(OXylyl)₃(Cp*)] Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 OXylyl (xylyloxy), Cp* (η⁵-pentamethylcyclopentadienyl) Molecular 6-coordinate: ③-●-3 piano stool

[Zr(OXylyl)₃(Cp*)]
fac–[Zr(OXylyl)₃(Tp*-κ³N)] Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 OXylyl (xylyloxy), Tp* (hydrotris(3,5-dimethylpyrazolyl)borato-κ³N) Molecular 6-coordinate: octahedron (OC-6)

fac–[Zr(OXylyl)₃(Tp*-κ³N)]
[Zr(Cp)₂}₂(μ₂-P)] Zirconium VN: 3 CN: 7 ON: (III) EN: 17 P group (X type), Cp (η⁵-cyclopentadienyl) Molecular 7-coordinate: ③₂-●-1 bent metallocene

[Zr(Cp)₂}₂(μ₂-P)]
[Zr(Pc)₂] Zirconium VN: 4 CN: 8 ON: (IV) EN: 16 Pc (phthalocyaninato) Molecular

[Zr(Pc)₂]
[Zr(PEt₃)(η⁵-C₅H₅Me₂)₂] Zirconium VN: 2 CN: 7 ON: (II) EN: 16 PEt₃ (triethylphosphane), C₅H₅Me₂ (η⁵-2,4-dimethylpentadienyl) Molecular 7-coordinate: ③₂-●-1 bent metallocene

[Zr(PEt₃)(η⁵-C₅H₅Me₂)₂]
[Zr(Ph)₂(Cp)₂] Zirconium VN: 4 CN: 8 ON: (IV) EN: 16 Ph (phenyl), Cp (η⁵-cyclopentadienyl) Molecular 8-coordinate: ③₂-●-2 bent metallocene

[Zr(Ph)₂(Cp)₂]
[Zr(Ph)₂(Cp*)₂] Zirconium VN: 4 CN: 8 ON: (IV) EN: 16 Ph (phenyl), Cp* (η⁵-pentamethylcyclopentadienyl) Molecular 8-coordinate: ③₂-●-2 bent metallocene

[Zr(Ph)₂(Cp*)₂]
[Zr(Ph)₅]⊖ Zirconium VN: 4 CN: 5 ON: (IV) EN: 10 Ph (phenyl) Molecular 5-coordinate: trigonal bipyramid (TBPY-5)

[Zr(Ph)₅]⊖
[Zr(Ph)₆]²⊖ Zirconium VN: 4 CN: 6 ON: (IV) EN: 12 Ph (phenyl) Molecular 6-coordinate: octahedron (OC-6)

[Zr(Ph)₆]²⊖
[Zr(Ph){CH(PPh₃)}(Cp)₂] Zirconium VN: 4 CN: 8 ON: (IV) EN: 18 Ph (phenyl), CH(PPh₃) (triphenylphosphinylidene-methyl), Cp (η⁵-cyclopentadienyl) Molecular 8-coordinate: ③₂-●-2 bent metallocene

[Zr(Ph){CH(PPh₃)}(Cp)₂]
[Zr(Ph){CH(SiMe₃)₂}(Cp)₂] Zirconium VN: 4 CN: 8 ON: (IV) EN: 16 Ph (phenyl), CH(SiMe₃)₂ (bistrimethylsilylmethyl), Cp (η⁵-cyclopentadienyl) Molecular 8-coordinate: ③₂-●-2 bent metallocene

[Zr(Ph){CH(SiMe₃)₂}(Cp)₂]
cis–[Zr(PhC≡CPh)(Oep)] Zirconium VN: 2 CN: 5 ON: (II) EN: 14 PhC≡CPh (diphenylethyne L₂), Oep (octaethylporphyrin) Molecular 5-coordinate: square-based pyramid (SPY-5)

cis–[Zr(PhC≡CPh)(Oep)]