Zirconium(II) hydride

Zirconium(II) hydride
Names
IUPAC name
Zirconium(II) hydride
Other names
  • Hydride;zirconium(2+)
  • Zirconium(2+) dihydride
  • Zirconium dihydride
Identifiers
3D model (JSmol)
ChemSpider
ECHA InfoCard 100.028.844
EC Number
  • 231-727-3
UNII
  • InChI=1S/Zr.2H
    Key: QSGNKXDSTRDWKA-UHFFFAOYSA-N
  • [ZrH2]
  • [H-].[H-].[Zr+2]
Properties
ZrH2
Molar mass 93.240 g/mol
Appearance Grey tetragonal crystals or dark gray to black metallic powder
Odor Odorless
Density 5.60 g/cm3
Melting point 800°C (decomposes)
Insoluble
Solubility Soluble in HF
Structure
tetragonal
dihedral (C2v)
Hazards
Occupational safety and health (OHS/OSH):
Main hazards
Skin irritation, eye irritation, flammable</ref>
GHS labelling:
Danger
H228, H315, H319, H335
P210, P240, P241, P261, P264, P271, P280, P302+P352, P304+P340+P312, P305+P351+P338, P332+P313, P337+P313, P362, P370+P378, P403+P233, P405, P501
NFPA 704 (fire diamond)
1
3
1
270 °C
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Y verify (what is YN ?)
Infobox references

Zirconium(II) hydride is a molecular chemical compound with the chemical formula ZrH2. It is a grey crystalline solid or dark gray to black powder. It has been prepared by laser ablation and isolated at low temperature.

Zirconium(II) hydride has repeatedly been the subject of DiracHartree–Fock relativistic calculation studies, which investigate the stabilities, geometries, and relative energies of hydrides of the formula MH4, MH3, MH2, or MH.

Zirconium(II) hydride has a dihedral (C2v) structure. In zirconium(II) hydride, the formal oxidation states of zirconium and hydrogen are +2 and −1, respectively, because the electronegativity of zirconium is lower than that of hydrogen. The stability of metal hydrides with the formula MH2 (M = Ti, Zr, Hf) decreases from Ti to Hf.