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. 2009 Oct 23;65(Pt 11):m1428-9.
doi: 10.1107/S1600536809042858.

Diaqua-bis[1-hydroxy-2-(imidazol-3-ium-1-yl)-1,1'-ethyl-idenediphophonato-κO,O']zinc(II)

Affiliations

Diaqua-bis[1-hydroxy-2-(imidazol-3-ium-1-yl)-1,1'-ethyl-idenediphophonato-κO,O']zinc(II)

Eleonora Freire et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

In the title complex, [Zn(C(5)H(9)NO(7)P(2))(2)(H(2)O)(2)], the zinc atom is coordinated by two bidentate zoledronate [zoledronate = (2-(1-imidazole)-1-hydr-oxy-1,1'-ethyl-idenediphophonate)] ligands and two water mol-ecules. The coordination number is 6. There is one half-mol-ecule in the asymmetric unit with the zinc atom located on a crystallographic inversion centre. The anion exists as a zwitterion with an overall charge of -1; the protonated nitro-gen in the ring has a positive charge and the two phospho-nates groups each have a single negative charge. There are two intra-molecular O-H⋯O hydrogen bonds. The mol-ecules are linked into a chain by inter-molecular O-H⋯O hydrogen bonds. Adjacent chains are further linked by O-H⋯O hydrogen bonds involving the aqua ligands. An N-H⋯O inter-action is also observed.

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Figures

Fig. 1.
Fig. 1.
: Molecular view of (I), showing the labeling scheme used. Hydrogen bonding is shown in dashed lines.
Fig. 2.
Fig. 2.
: View of the intra chain H-bonds in (I).

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