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Volume 64 
Part 10 
Page m1249  
October 2008  

Received 30 August 2008
Accepted 3 September 2008
Online 6 September 2008

Key indicators
Single-crystal X-ray study
T = 293 K
Mean [sigma](C-C) = 0.010 Å
R = 0.063
wR = 0.166
Data-to-parameter ratio = 18.7
Details
Open access

Iodido(1,10-phenanthroline-[kappa]2N,N')(piperine-1-carbodithioato-[kappa]2S,S')copper(II)

aInstitute of Materials Physical Chemistry, and Key Laboratory for Functional Materials of Fujian Higher Education, Huaqiao University, Quanzhou, Fujian 362021, People's Republic of China
Correspondence e-mail: lqfan@hqu.edu.cn

In the title compound, [Cu(C6H10NS2)I(C12H8N2)], the CuII ion is coordinated by one iodide ion, two N atoms of the phenanthroline ligand and two S atoms from the piperidyldithiocarbamate ligand in a distorted square-pyramidal environment.

Related literature

For related literature, see: Englhardt et al. (1998[Englhardt, L. M., Healy, P. C., Shephard, R. M., Skelton, B. W. & White, A. W. (1998). Inorg. Chem. 27, 2371-2373.]); Fernández et al. (2000[Fernández, E. J., López-de-Luzuriaga, J. M., Monge, M., Olmos, E., Laguna, A., Villacampa, M. D. & Jones, P. G. (2000). J. Cluster Sci. 11, 153-166.]); Koh et al. (2003[Koh, Y. W., Lai, C. S., Du, A. Y., Tiekink, E. R. T. & Loh, K. P. (2003). Chem. Mater. 15, 4544-4554.]); Noro et al. (2000[Noro, S., Kitagawa, S., Kondo, M. & Seki, K. (2000). Angew. Chem. Int. Ed. 39, 2081-2084.]); Yaghi et al. (1998[Yaghi, O. M., Li, H., David, C., Richardson, D. & Groy, T. L. (1998). Acc. Chem. Res. 31, 474-484.]).

[Scheme 1]

Experimental

Crystal data
  • [Cu(C6H10NS2)I(C12H8N2)]

  • Mr = 530.91

  • Monoclinic, P 21 /c

  • a = 6.408 (4) Å

  • b = 17.11 (1) Å

  • c = 18.400 (9) Å

  • [beta] = 108.42 (2)°

  • V = 1914 (2) Å3

  • Z = 4

  • Mo K[alpha] radiation

  • [mu] = 2.98 mm-1

  • T = 293 (2) K

  • 0.40 × 0.08 × 0.03 mm

Data collection
  • Rigaku Mercury CCD diffractometer

  • Absorption correction: multi-scan (CrystalClear; Rigaku,2000[Rigaku (2000). CrystalClear. Rigaku Corporation, Akishima, Tokyo, Japan.]) Tmin = 0.751, Tmax = 0.915

  • 14752 measured reflections

  • 4236 independent reflections

  • 3298 reflections with I > 2[sigma](I)

  • Rint = 0.069

Refinement
  • R[F2 > 2[sigma](F2)] = 0.063

  • wR(F2) = 0.166

  • S = 1.09

  • 4236 reflections

  • 226 parameters

  • H-atom parameters constrained

  • [Delta][rho]max = 1.41 e Å-3

  • [Delta][rho]min = -1.52 e Å-3

Data collection: CrystalClear (Rigaku, 2000[Rigaku (2000). CrystalClear. Rigaku Corporation, Akishima, Tokyo, Japan.]); cell refinement: CrystalClear; data reduction: CrystalClear; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); molecular graphics: SHELXTL (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); software used to prepare material for publication: SHELXTL.


Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: IM2082 ).


Acknowledgements

This work was supported financially by the Research Fund of Huaqiao University (No. 06BS216) and the Young Talent Fund of Fujian Province (No. 2007F3060).

References

Englhardt, L. M., Healy, P. C., Shephard, R. M., Skelton, B. W. & White, A. W. (1998). Inorg. Chem. 27, 2371-2373.  [CrossRef]
Fernández, E. J., López-de-Luzuriaga, J. M., Monge, M., Olmos, E., Laguna, A., Villacampa, M. D. & Jones, P. G. (2000). J. Cluster Sci. 11, 153-166.  [ISI] [CSD] [CrossRef] [ChemPort]
Koh, Y. W., Lai, C. S., Du, A. Y., Tiekink, E. R. T. & Loh, K. P. (2003). Chem. Mater. 15, 4544-4554.  [ISI] [CSD] [CrossRef] [ChemPort]
Noro, S., Kitagawa, S., Kondo, M. & Seki, K. (2000). Angew. Chem. Int. Ed. 39, 2081-2084.  [CrossRef]
Rigaku (2000). CrystalClear. Rigaku Corporation, Akishima, Tokyo, Japan.
Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.  [CrossRef] [details]
Yaghi, O. M., Li, H., David, C., Richardson, D. & Groy, T. L. (1998). Acc. Chem. Res. 31, 474-484.  [ISI] [CrossRef] [ChemPort]


Acta Cryst (2008). E64, m1249  [ doi:10.1107/S1600536808028213 ]

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