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Crystal and molecular structure of the potassium salt of 2,4-di-iso-propoxy-6-dinitromethyl-1,3,5-triazine

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Abstract

An X-ray diffraction study of the potassium salt of 2,4-di-iso-propoxy-6-dinitromethyl-1,3,5-triazine was performed. Monoclinic crystals, C10H14N5O −6 ·K+; M = 339.36; a = 9.645(2) Å, b = 8.803(2) Å, c = 17.686(3) Å; β = 92.50(2)°; V = 1500.2(5) Å 3, d c = 1.50 g/cm3, Z = 4, space group P21/a. The 2,4-di-iso-propoxy-6-dinitromethyl-1,3,5-triazine anion is nonplanar. The 1,3,5-triazine heterocycle is planar; the angle between the ring and the dinitromethyl fragment is 87.9(5)°. The potassium cation is in the general position; its coordination number is 7. The cation is bonded to four 2,4-di-iso-propoxy-6-dinitromethyl-1,3,5-triazine molecules. Infinite layers are formed due to the coordination bonds in crystal.

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Authors and Affiliations

  1. Samara State Technical University, Russia

    V. V. Bakharev & A. A. Gidaspov

  2. A. E. Arbuzov Institute of Organic and Physical Chemistry, Kazan Scientific Center, Kazan

    I. A. Litvinov & E. V. Mironova

Authors
  1. V. V. Bakharev
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  2. A. A. Gidaspov
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  3. I. A. Litvinov
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  4. E. V. Mironova
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Correspondence to V. V. Bakharev.

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Original Russian Text Copyright © 2007 by V. V. Bakharev, A. A. Gidaspov, I. A. Litvinov, and E. V. Mironova

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Translated from Zhurnal Strukturnoi Khimii, Vol. 48, No. 6, pp. 1230–1233, November–December, 2007.

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Bakharev, V.V., Gidaspov, A.A., Litvinov, I.A. et al. Crystal and molecular structure of the potassium salt of 2,4-di-iso-propoxy-6-dinitromethyl-1,3,5-triazine. J Struct Chem 48, 1164–1167 (2007). https://doi.org/10.1007/s10947-007-0188-4

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  • DOI: https://doi.org/10.1007/s10947-007-0188-4

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