The crystal structure of the natural 1,2,4-triazolate compound NaCu<sub>2</sub>Cl<sub>3</sub>[N<sub>3</sub>C<sub>2</sub>H<sub>2</sub>]<sub>2</sub>[NH<sub>3</sub>]<sub>2</sub>•4H<sub>2</sub>O

Autor(en)
Natalia V Zubkova, N V Chukanov, Igor V Pekov, Gerhard Möhn, Gerald Giester, Vasiliy O. Yapaskurt, Inna Lykova, Dmitry Y. Pushcharovsky
Abstrakt

The crystal structure of a new natural compound NaCu2Cl3[N3C2H2]2[NH3]2·4H2O, (further denoted I in the text) from a guano deposit located on the Pabellón de Pica Mountain, Iquique Province, Tarapacá Region, Chile, was studied by single-crystal low-temperature (200 K) XRD, R=2.42%. The compound I is orthorhombic, space group P212121; a=19.484(3), b=7.2136(10), c=11.999(4) Å, V=1686.5(7) Å3, Z=4. The crystal structure of I contains zig-zag chains of the corner-sharing Cu(1)-centered octahedra running along the a axis and isolated Cu(2)-centered octahedra connected with the chains via 1,2,4-triazolate anions. This structural fragment is close to that found in the mineral chanabayaite, Cu2(N3C2H2)2Cl(NH3, Cl, H2O, □)4. In contrast to Na-free chanabayaite, in the structure of I Na cations occupy Na(H2O)6 octahedra connected via common edges to form chains parallel to the chains of Cu(1)-centered octahedra. I is the second natural compound, after chanabayaite, with 1,2,4-triazolate anions N3C2H2- and is assumed to be a protophase of chanabayaite; the latter was presumably formed as a result of Na and Cl leaching and dehydration of I.

Organisation(en)
Institut für Mineralogie und Kristallographie
Externe Organisation(en)
Lomonosov Moscow State University (MSU), Russian Academy of Sciences, Independent researcher
Journal
Zeitschrift für Kristallographie - Crystalline Materials
Band
231
Seiten
47-53
Anzahl der Seiten
7
ISSN
2194-4946
DOI
https://doi.org/10.1515/zkri-2015-1861
Publikationsdatum
01-2016
Peer-reviewed
Ja
ÖFOS 2012
105116 Mineralogie, 105113 Kristallographie
Schlagwörter
ASJC Scopus Sachgebiete
Condensed Matter Physics, Materials Science(all), Inorganic Chemistry
Link zum Portal
https://ucrisportal.univie.ac.at/de/publications/the-crystal-structure-of-the-natural-124triazolate-compound-nacu2cl3n3c2h22nh324h2o(2c4d4236-d6ad-4ea2-a143-313d7b4d4fcb).html