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Volume 68 
Part 3 
Page m303  
March 2012  

Received 7 February 2012
Accepted 12 February 2012
Online 17 February 2012

Key indicators
Single-crystal X-ray study
T = 298 K
Mean [sigma](C-C) = 0.020 Å
Disorder in main residue
R = 0.083
wR = 0.224
Data-to-parameter ratio = 17.9
Details
Open access

catena-Poly[[diiodidomercury(II)]-[mu]2-2-aminopyrazine-[kappa]2N1:N4]

aDepartment of Chemistry, Omidieh Branch, Islamic Azad University, Omidieh, Iran, and bDepartment of Chemistry, Mahshahr Branch, Islamic Azad University, Mahshar, Iran
Correspondence e-mail: sadif_shirvan1@yahoo.com

In the crystal of the title polymeric compound, [HgI2(C4H5N3)]n, the HgII cation is located on a twofold rotation axis and is coordinated by two I- anions and two 2-aminopyrazine ligands in a distorted HgI2N2 tetrahedral geometry. In the crystal, the 2-aminopyrazine ligand is equally disordered over two positions about an inversion center, and bridges the HgII cations with pyrazine N atoms to form a polymeric chain running along the c axis. In the polymeric chain, the amino groups link to the coordinated I- anions via intermolecular N-H...I hydrogen bonds.

Related literature

For related structures, see: Sun et al. (2009[Sun, D., Luo, G.-G., Zhang, N., Huang, R.-B. & Zheng, L.-S. (2009). Acta Cryst. C65, m478-m480.]); Pagola et al. (2008[Pagola, S., Pike, R. D., deKrafft, K. & Tronic, T. A. (2008). Acta Cryst. C64, m134-m136.]); Boonmak et al. (2010[Boonmak, J., Nakano, M., Chaichit, N., Pakawatchai, C. & Youngme, S. (2010). Dalton Trans. 39, 8161-8167.]); Gao & Ng (2011[Gao, S. & Ng, S. W. (2011). Acta Cryst. E67, m1049-m1050.]); Goher et al. (2008[Goher, M. A. S., Mautner, F. A., Sodin, B. & Bitschnau, B. (2008). J. Mol. Struct. 879, 96-101.]).

[Scheme 1]

Experimental

Crystal data
  • [HgI2(C4H5N3)]

  • Mr = 549.50

  • Monoclinic, C 2/c

  • a = 15.3389 (19) Å

  • b = 6.8791 (8) Å

  • c = 9.6239 (11) Å

  • [beta] = 103.828 (10)°

  • V = 986.1 (2) Å3

  • Z = 4

  • Mo K[alpha] radiation

  • [mu] = 21.81 mm-1

  • T = 298 K

  • 0.50 × 0.05 × 0.04 mm

Data collection
  • Bruker APEXII CCD area-detector diffractometer

  • Absorption correction: multi-scan (SADABS; Bruker, 2001[Bruker (2001). SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]) Tmin = 0.275, Tmax = 0.417

  • 2648 measured reflections

  • 933 independent reflections

  • 911 reflections with I > 2[sigma](I)

  • Rint = 0.173

Refinement
  • R[F2 > 2[sigma](F2)] = 0.083

  • wR(F2) = 0.224

  • S = 1.08

  • 933 reflections

  • 52 parameters

  • H-atom parameters constrained

  • [Delta][rho]max = 2.67 e Å-3

  • [Delta][rho]min = -2.69 e Å-3

Table 1
Selected bond lengths (Å)

Hg1-I1 2.6373 (13)
Hg1-N1i 2.497 (11)
Symmetry code: (i) [-x, y, -z+{\script{3\over 2}}].

Table 2
Hydrogen-bond geometry (Å, °)

D-H...A D-H H...A D...A D-H...A
N2-H2A...I1i 0.86 2.83 3.67 (3) 169
Symmetry code: (i) [-x, y, -z+{\script{3\over 2}}].

Data collection: APEX2 (Bruker, 2007[Bruker (2007). APEX2 and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.]); cell refinement: SAINT (Bruker, 2007[Bruker (2007). APEX2 and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.]); data reduction: SAINT; program(s) used to solve structure: SHELXTL (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); program(s) used to refine structure: SHELXTL; molecular graphics: ORTEP-3 for Windows (Farrugia, 1997[Farrugia, L. J. (1997). J. Appl. Cryst. 30, 565.]); software used to prepare material for publication: WinGX (Farrugia, 1999[Farrugia, L. J. (1999). J. Appl. Cryst. 32, 837-838.]).


Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: XU5467 ).


Acknowledgements

We are grateful to the Islamic Azad University, Omidieh Branch, for financial support.

References

Boonmak, J., Nakano, M., Chaichit, N., Pakawatchai, C. & Youngme, S. (2010). Dalton Trans. 39, 8161-8167.  [CSD] [CrossRef] [ChemPort] [PubMed]
Bruker (2001). SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.
Bruker (2007). APEX2 and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.
Farrugia, L. J. (1997). J. Appl. Cryst. 30, 565.  [CrossRef] [details]
Farrugia, L. J. (1999). J. Appl. Cryst. 32, 837-838.  [CrossRef] [ChemPort] [details]
Gao, S. & Ng, S. W. (2011). Acta Cryst. E67, m1049-m1050.  [CrossRef] [details]
Goher, M. A. S., Mautner, F. A., Sodin, B. & Bitschnau, B. (2008). J. Mol. Struct. 879, 96-101.  [ISI] [CSD] [CrossRef] [ChemPort]
Pagola, S., Pike, R. D., deKrafft, K. & Tronic, T. A. (2008). Acta Cryst. C64, m134-m136.  [CSD] [CrossRef] [details]
Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.  [CrossRef] [details]
Sun, D., Luo, G.-G., Zhang, N., Huang, R.-B. & Zheng, L.-S. (2009). Acta Cryst. C65, m478-m480.  [CSD] [CrossRef] [details]


Acta Cryst (2012). E68, m303  [ doi:10.1107/S1600536812006149 ]

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