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Volume 68 
Part 6 
Page m753  
June 2012  

Received 29 April 2012
Accepted 6 May 2012
Online 12 May 2012

Key indicators
Single-crystal X-ray study
T = 296 K
Mean [sigma](C-C) = 0.005 Å
R = 0.033
wR = 0.075
Data-to-parameter ratio = 16.2
Details
Open access

{4,4',6,6'-Tetrabromo-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}nickel(II)

aDepartment of Chemistry, Payame Noor University, PO Box 19395-3697 Tehran, I. R. of IRAN,bDepartment of Chemistry, Science and Research Branch, Islamic Azad University, Tehran, Iran, and cDepartment of Physics, University of Sargodha, Punjab, Pakistan
Correspondence e-mail: h.kargar@pnu.ac.ir, dmntahir_uos@yahoo.com

The asymmetric unit of the title compound, [Ni(C19H16Br4N2O2)], comprises half of a Schiff base complex. The geometry around the NiII atom, located on a twofold rotation axis, is distorted square-planar, which is supported by the N2O2 donor atoms of the coordinated ligand. The dihedral angle between the substituted benzene rings is 23.19 (17)°. In the crystal, a short intermolecular Br...Br [3.6475 (7) Å] interaction is present.

Related literature

For applications of Schiff bases in coordination chemistry, see: Granovski et al. (1993[Granovski, A. D., Nivorozhkin, A. L. & Minkin, V. I. (1993). Coord. Chem. Rev. 126, 1-69.]); Blower (1998[Blower, P. J. (1998). Transition Met. Chem., 23, 109-112.]). For related structures, see: Ghaemi et al. (2011[Ghaemi, A., Rayati, S., Elahi, E., Ng, S. W. & Tiekink, E. R. T. (2011). Acta Cryst. E67, m1445-m1446.]); Kargar et al. (2012[Kargar, H., Kia, R., Sharafi, Z. & Tahir, M. N. (2012). Acta Cryst. E68, m82.]). For van der Waals radii, see: Bondi (1964[Bondi, A. (1964). J. Phys. Chem. 68, 441-452.]). For standard values of bond lengths, see: Allen et al. (1987[Allen, F. H., Kennard, O., Watson, D. G., Brammer, L., Orpen, A. G. & Taylor, R. (1987). J. Chem. Soc. Perkin Trans. 2, pp. S1-19.]).

[Scheme 1]

Experimental

Crystal data
  • [Ni(C19H16Br4N2O2)]

  • Mr = 682.69

  • Orthorhombic, P b c n

  • a = 16.1125 (11) Å

  • b = 15.4789 (12) Å

  • c = 8.4734 (5) Å

  • V = 2113.3 (3) Å3

  • Z = 4

  • Mo K[alpha] radiation

  • [mu] = 8.50 mm-1

  • T = 296 K

  • 0.25 × 0.18 × 0.09 mm

Data collection
  • Bruker SMART APEXII CCD area-detector diffractometer

  • Absorption correction: multi-scan (SADABS; Bruker, 2005[Bruker (2005). APEX2, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]) Tmin = 0.694, Tmax = 0.871

  • 16236 measured reflections

  • 2086 independent reflections

  • 1574 reflections with I > 2[sigma](I)

  • Rint = 0.049

Refinement
  • R[F2 > 2[sigma](F2)] = 0.033

  • wR(F2) = 0.075

  • S = 1.05

  • 2086 reflections

  • 129 parameters

  • H-atom parameters constrained

  • [Delta][rho]max = 0.52 e Å-3

  • [Delta][rho]min = -0.78 e Å-3

Data collection: APEX2 (Bruker, 2005[Bruker (2005). APEX2, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]); cell refinement: SAINT (Bruker, 2005[Bruker (2005). APEX2, SAINT and SADABS. 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 and PLATON (Spek, 2009[Spek, A. L. (2009). Acta Cryst. D65, 148-155.]).


Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: SU2421 ).


Acknowledgements

HK thanks PNU for financial support. MNT thanks GC University of Sargodha, Pakistan for the research facility.

References

Allen, F. H., Kennard, O., Watson, D. G., Brammer, L., Orpen, A. G. & Taylor, R. (1987). J. Chem. Soc. Perkin Trans. 2, pp. S1-19.
Blower, P. J. (1998). Transition Met. Chem., 23, 109-112.  [CrossRef] [ChemPort]
Bondi, A. (1964). J. Phys. Chem. 68, 441-452.  [ISI] [CrossRef] [ChemPort]
Bruker (2005). APEX2, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.
Ghaemi, A., Rayati, S., Elahi, E., Ng, S. W. & Tiekink, E. R. T. (2011). Acta Cryst. E67, m1445-m1446.  [CSD] [CrossRef] [details]
Granovski, A. D., Nivorozhkin, A. L. & Minkin, V. I. (1993). Coord. Chem. Rev. 126, 1-69.
Kargar, H., Kia, R., Sharafi, Z. & Tahir, M. N. (2012). Acta Cryst. E68, m82.  [CSD] [CrossRef] [details]
Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.  [CrossRef] [details]
Spek, A. L. (2009). Acta Cryst. D65, 148-155.  [ISI] [CrossRef] [details]


Acta Cryst (2012). E68, m753  [ doi:10.1107/S1600536812020375 ]

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