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Volume 69 
Part 10 
Page m553  
October 2013  

Received 9 August 2013
Accepted 13 September 2013
Online 21 September 2013

Key indicators
Single-crystal X-ray study
T = 296 K
Mean [sigma](C-C) = 0.009 Å
R = 0.039
wR = 0.122
Data-to-parameter ratio = 17.2
Details
Open access

{9-Hexyl-2-[2-phenyl-6-(pyridin-2-yl)pyridin-4-yl]-9H-carbazole}diiodidozinc

aDepartment of Chemistry, Anhui University, Hefei 230039, People's Republic of China, and Key Laboratory of Functional Inorganic Materials, Chemistry, Hefei 230039, People's Republic of China
Correspondence e-mail: yptian@ahu.edu.cn

In the title compound, [ZnI2(C34H31N3)], the ZnII atom is four-coordinated by two I atoms and the pyridine N atoms from the bidentate 6'-phenyl-2,2'-bipyridine ligand in a distorted tetrahedral geometry.

Related literature

For the synthesis of the title compound and related structures, see: Alizadeh et al. (2009[Alizadeh, R., Kalateh, K., Khoshtarkib, Z., Ahmadi, R. & Amani, V. (2009). Acta Cryst. E65, m1439-m1440.]); Gao et al. (2009[Gao, Y. H., Wu, J. Y., Li, Y. M., Sun, P. P., Zhou, H. P., Yang, J. X., Zhang, S. Y., Jin, B. K. & Tian, Y. P. (2009). J. Am. Chem. Soc. 131, 5208-5213.]); Prokhorov et al. (2011[Prokhorov, A. M., Slepukhin, P. A., Rusinov, V. L., Kalinin, V. N. & Kozhevnikov, D. N. (2011). Chem. Commun. 47, 7713-7715.]).

[Scheme 1]

Experimental

Crystal data
  • [ZnI2(C34H31N3)]

  • Mr = 800.79

  • Monoclinic, P 21 /n

  • a = 15.3870 (14) Å

  • b = 9.8771 (9) Å

  • c = 21.3246 (19) Å

  • [beta] = 99.306 (1)°

  • V = 3198.2 (5) Å3

  • Z = 4

  • Mo K[alpha] radiation

  • [mu] = 2.73 mm-1

  • T = 296 K

  • 0.22 × 0.22 × 0.21 mm

Data collection
  • Bruker SMART CCD area-detector diffractometer

  • Absorption correction: multi-scan (SADABS; Sheldrick, 2002[Sheldrick, G. M. (2002). SADABS. University of Göttingen, Germany.]) Tmin = 0.586, Tmax = 0.598

  • 23438 measured reflections

  • 6226 independent reflections

  • 5325 reflections with I > 2[sigma](I)

  • Rint = 0.022

Refinement
  • R[F2 > 2[sigma](F2)] = 0.039

  • wR(F2) = 0.122

  • S = 1.04

  • 6226 reflections

  • 362 parameters

  • H-atom parameters constrained

  • [Delta][rho]max = 1.10 e Å-3

  • [Delta][rho]min = -0.92 e Å-3

Data collection: SMART (Bruker, 2002[Bruker (2002). SMART and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.]); cell refinement: SAINT (Bruker, 2002[Bruker (2002). SMART and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.]); data reduction: SAINT; 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: HP2061 ).


Acknowledgements

This work was supported by the National Natural Science Foundation of China (21071001, 21271004).

References

Alizadeh, R., Kalateh, K., Khoshtarkib, Z., Ahmadi, R. & Amani, V. (2009). Acta Cryst. E65, m1439-m1440.  [CrossRef] [ChemPort] [IUCr Journals]
Bruker (2002). SMART and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.
Gao, Y. H., Wu, J. Y., Li, Y. M., Sun, P. P., Zhou, H. P., Yang, J. X., Zhang, S. Y., Jin, B. K. & Tian, Y. P. (2009). J. Am. Chem. Soc. 131, 5208-5213.  [Web of Science] [CSD] [CrossRef] [PubMed] [ChemPort]
Prokhorov, A. M., Slepukhin, P. A., Rusinov, V. L., Kalinin, V. N. & Kozhevnikov, D. N. (2011). Chem. Commun. 47, 7713-7715.  [CSD] [CrossRef] [ChemPort]
Sheldrick, G. M. (2002). SADABS. University of Göttingen, Germany.
Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.  [CrossRef] [ChemPort] [IUCr Journals]


Acta Cryst (2013). E69, m553  [ doi:10.1107/S1600536813025464 ]

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