Structure of the calcium pyrophosphate monohydrate phase (Ca2P2O7·H2O): towards understanding the dehydration process in calcium pyrophosphate hydrates

Acta Crystallogr C Struct Chem. 2014 Sep;70(Pt 9):862-6. doi: 10.1107/S2053229614017446. Epub 2014 Aug 9.

Abstract

Calcium pyrophosphate hydrate (CPP, Ca(2)P(2)O(7) · nH2O) and calcium orthophosphate compounds (including apatite, octacalcium phosphate etc.) are among the most prevalent pathological calcifications in joints. Even though only two dihydrated forms of CPP (CPPD) have been detected in vivo (monoclinic and triclinic CPPD), investigations of other hydrated forms such as tetrahydrated or amorphous CPP are relevant to a further understanding of the physicochemistry of those phases of biological interest. The synthesis of single crystals of calcium pyrophosphate monohydrate (CPPM; Ca(2)P(2)O(7) · H2O) by diffusion in silica gel at ambient temperature and the structural analysis of this phase are reported in this paper. Complementarily, data from synchrotron X-ray diffraction on a CPPM powder sample have been fitted to the crystal parameters. Finally, the relationship between the resolved structure for the CPPM phase and the structure of the tetrahydrated calcium pyrophosphate β phase (CPPT-β) is discussed.

Keywords: calcium pyrophosphate hydrates; crystal structure; pathological calcification; powder diffraction; structure determination; synchrotron study.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Apatites / chemistry*
  • Calcium Phosphates / chemistry*
  • Calcium Pyrophosphate / chemistry*
  • Desiccation
  • Phosphates / chemistry*
  • X-Ray Diffraction

Substances

  • Apatites
  • Calcium Phosphates
  • Phosphates
  • octacalcium phosphate
  • calcium phosphate, dihydrate
  • Calcium Pyrophosphate