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Volume 67 
Part 2 
Page m251  
February 2011  

Received 14 January 2011
Accepted 18 January 2011
Online 22 January 2011

Key indicators
Single-crystal X-ray study
T = 100 K
Mean [sigma](C-C) = 0.003 Å
R = 0.023
wR = 0.047
Data-to-parameter ratio = 18.4
Details
Open access

Di-[mu]-thiocyanato-[kappa]2N:S;[kappa]2S:N-bis({2-morpholino-N-[1-(2-pyridyl)ethylidene]ethanamine-[kappa]3N,N',N''}(thiocyanato-[kappa]N)cadmium)

aDepartment of Chemistry, University of Malaya, 50603 Kuala Lumpur, Malaysia
Correspondence e-mail: khaledi@siswa.um.edu.my

In the title complex, [Cd2(NCS)4(C13H19N3O)2], the two CdII ions are bridged by a pair of thiocyanate N:S-bridging ligands around an inversion center. One terminal thiocyanate N atom and one N,N',N''-tridentate Schiff base ligand complete a distorted CdN5S octahedral geometry about each CdII atom. In the crystal, the Schiff base aromatic rings of adjacent molecules are arranged above each other into infinite chains along the a axis with alternate centroid-centroid separations of 3.5299 (13) and 3.7857 (13) Å.

Related literature

For the structure of the Cu(II) complex with the same Schiff base and thiocyanate, see: Suleiman Gwaram et al. (2011[Suleiman Gwaram, N., Ikmal Hisham, N. A., Khaledi, H. & Mohd Ali, H. (2011). Acta Cryst. E67, m58.]). For the structures of similar cadmium complexes, see: Banerjee et al. (2005[Banerjee, S., Wu, B., Lassahn, P.-G., Janiak, C. & Ghosh, A. (2005). Inorg. Chim. Acta, 358, 535-544.]); You et al. (2006[You, Z.-L., Jiao, Q.-Z., Niu, S.-Y. & Chi, J.-Y. (2006). Z. Anorg. Allg. Chem. 632, 2486-2490.]).

[Scheme 1]

Experimental

Crystal data
  • [Cd2(NCS)4(C13H19N3O)2]

  • Mr = 923.74

  • Monoclinic, P 21 /c

  • a = 7.2934 (2) Å

  • b = 26.4035 (5) Å

  • c = 10.0111 (3) Å

  • [beta] = 107.853 (3)°

  • V = 1835.02 (9) Å3

  • Z = 2

  • Mo K[alpha] radiation

  • [mu] = 1.43 mm-1

  • T = 100 K

  • 0.38 × 0.23 × 0.07 mm

Data collection
  • Bruker APEXII CCD diffractometer

  • Absorption correction: multi-scan (SADABS; Sheldrick, 1996[Sheldrick, G. M. (1996). SADABS. University of Göttingen, Germany.]) Tmin = 0.613, Tmax = 0.907

  • 15344 measured reflections

  • 4008 independent reflections

  • 3638 reflections with I > 2[sigma](I)

  • Rint = 0.026

Refinement
  • R[F2 > 2[sigma](F2)] = 0.023

  • wR(F2) = 0.047

  • S = 1.10

  • 4008 reflections

  • 218 parameters

  • 2 restraints

  • H-atom parameters constrained

  • [Delta][rho]max = 0.39 e Å-3

  • [Delta][rho]min = -0.45 e Å-3

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: 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: X-SEED (Barbour, 2001[Barbour, L. J. (2001). J. Supramol. Chem. 1, 189-191.]); software used to prepare material for publication: SHELXL97 and publCIF (Westrip, 2010[Westrip, S. P. (2010). J. Appl. Cryst. 43, 920-925.]).


Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: OM2400 ).


Acknowledgements

The authors thank the University of Malaya for funding this study (FRGS grant No. FP004/2010B).

References

Banerjee, S., Wu, B., Lassahn, P.-G., Janiak, C. & Ghosh, A. (2005). Inorg. Chim. Acta, 358, 535-544.  [ISI] [CSD] [CrossRef] [ChemPort]
Barbour, L. J. (2001). J. Supramol. Chem. 1, 189-191.  [CrossRef] [ChemPort]
Bruker (2007). APEX2 and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.
Sheldrick, G. M. (1996). SADABS. University of Göttingen, Germany.
Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.  [CrossRef] [details]
Suleiman Gwaram, N., Ikmal Hisham, N. A., Khaledi, H. & Mohd Ali, H. (2011). Acta Cryst. E67, m58.  [CrossRef] [details]
Westrip, S. P. (2010). J. Appl. Cryst. 43, 920-925.  [ISI] [CrossRef] [ChemPort] [details]
You, Z.-L., Jiao, Q.-Z., Niu, S.-Y. & Chi, J.-Y. (2006). Z. Anorg. Allg. Chem. 632, 2486-2490.  [CrossRef] [ChemPort]


Acta Cryst (2011). E67, m251  [ doi:10.1107/S1600536811002480 ]

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