Gossman William L, Wilson Scott R, Oldfield Eric
University of Illinois, Department of Chemistry, 600 South Mathews Avenue, Urbana, Illinois 61801, USA.
Acta Crystallogr C. 2002 Dec;58(Pt 12):m599-600. doi: 10.1107/s0108270102019522. Epub 2002 Nov 20.
The title compound, Na(+).C(5)H(9)N(2)O(7)P(2)(-).4H(2)O, is an isomer of zoledronate, a potent bone antiresorptive bisphosphonate drug having significant activity against several parasitic protozoa. The crystal structure of isozoledronate consists of bisphosphonate dimers coordinated by two Na(+) ions. The dimers are held together through an extensive hydrogen-bonding network. The crystals exhibit non-merohedral twinning that roughly superimposes the a and b axes, and inverts the c axis.