Zeitschrift für Kristallographie - New Crystal Structures (Oct 2023)

Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O

  • Radović Ana,
  • Giester Gerald,
  • Tomić Zoran D.,
  • Kočović David,
  • Jaćimović Željko K.

DOI
https://doi.org/10.1515/ncrs-2023-0199
Journal volume & issue
Vol. 238, no. 5
pp. 827 – 829

Abstract

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C4H2N3BrO4·H2O, monoclinic, P21/c (no. 14), a = 7.177(2) Å, b = 10.999(3) Å, c = 10.414(3) Å, β = 100.145(11)∘$100.145{(11)}^{\circ }$, V = 809.3(4) Å3, Z = 4, Rgt${R}_{\mathrm{g}\mathrm{t}}$(F) = 0.0379, wRref$w{R}_{\mathrm{r}\mathrm{e}\mathrm{f}}$(F2) = 0.0714, T = 200 K

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