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

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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Main Authors: Radović Ana, Giester Gerald, Tomić Zoran D., Kočović David, Jaćimović Željko K.
Format: Article
Language:English
Published: De Gruyter 2023-10-01
Series:Zeitschrift für Kristallographie - New Crystal Structures
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Online Access:https://doi.org/10.1515/ncrs-2023-0199
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author Radović Ana
Giester Gerald
Tomić Zoran D.
Kočović David
Jaćimović Željko K.
author_facet Radović Ana
Giester Gerald
Tomić Zoran D.
Kočović David
Jaćimović Željko K.
author_sort Radović Ana
collection DOAJ
description 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
format Article
id doaj-art-2b1edc2364814a5d94425832cdb7fec4
institution Kabale University
issn 1433-7266
2197-4578
language English
publishDate 2023-10-01
publisher De Gruyter
record_format Article
series Zeitschrift für Kristallographie - New Crystal Structures
spelling doaj-art-2b1edc2364814a5d94425832cdb7fec42025-02-02T15:46:40ZengDe GruyterZeitschrift für Kristallographie - New Crystal Structures1433-72662197-45782023-10-01238582782910.1515/ncrs-2023-0199Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2ORadović Ana0Giester Gerald1Tomić Zoran D.2Kočović David3Jaćimović Željko K.4Accreditation Body of Montenegro, Jovana Tomaševića 1, 81000Podgorica, MontenegroInstitut für Mineralogie und Kristallographie, Althanstraße 14, Universität Wien – Geozentrum, 1090Wien, AustriaDepartment of Theoretical Physics and Condensed Matter Physics, VINČAInstitute of Nuclear Sciences, National Institute of the Republic of Serbia, University of Belgrade, PO Box 522, 11001, Belgrade, SerbiaInstitute for Medicines and Medical Devices of Montenegro, 81000Podgorica, MontenegroFaculty of Metallurgy and Technology Džordža Vašingtona, University of Montenegro, Podgorica, MontenegroC4H2N3BrO4·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 Khttps://doi.org/10.1515/ncrs-2023-01992269769
spellingShingle Radović Ana
Giester Gerald
Tomić Zoran D.
Kočović David
Jaćimović Željko K.
Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
Zeitschrift für Kristallographie - New Crystal Structures
2269769
title Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
title_full Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
title_fullStr Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
title_full_unstemmed Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
title_short Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid monohydrate, C4H2N3BrO4·H2O
title_sort crystal structure of 4 bromo 3 nitro 1h pyrazole 5 carboxylic acid monohydrate c4h2n3bro4·h2o
topic 2269769
url https://doi.org/10.1515/ncrs-2023-0199
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