Featuring non-covalent interactions in m-xylylenediaminium bis(perchlorate) monohydrate: Synthesis, characterization and Hirshfeld surface analysis
Journal of Molecular Structure, ISSN: 0022-2860, Vol: 1194, Page: 66-72
2019
- 27Citations
- 8Captures
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Example: if you select the 1-year option for an article published in 2019 and a metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019. If you select the 3-year option for the same article published in 2019 and the metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019, 2018 and 2017.
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Article Description
The novel compound (C8H14N2)(ClO4)2.H2O (MXClO4) has been elaborated by slow evaporation at room temperature and characterized by X-ray single crystal analysis, Hirshfeld surface analysis, differential scanning calorimetry analysis (DSC), IR and Raman spectroscopies. MXClO4 crystallized in the monoclinic system, space group P21/c, with a = 5.5781(10) Å, b = 11.1137(3) Å, c = 23.0731(7) Å, β = 95.414(1) º, V = 1424.0(3) Å3 and Z = 4. The asymmetric unit of the title compound contains one m-xylylenediaminium cation, two perchlorate anions and one water molecule. The atomic arrangement of the title compound can be described by a three-dimensional network. Therefore, chlorine atoms, Cl2, are discrete and Cl1 form with water molecules corrugated C22(5) infinite chains of formula (ClH2O5)nn− extending along the a-axis at z = ¼ and ¾. These inorganic entities are allied to organic cations (C8H14N2)2 + through involved hydrogen bonding. The intermolecular interactions were further evaluated by using the three-dimensional Hirshfeld surfaces and two-dimensional fingerprint plots. The hydrogen bonding interactions associated to OW–H…O, N–H⋯O, N–H…OW and C–H⋯O represent the top fraction of 69.1% followed by these of the H⋯H type contributing 17.5%.
Bibliographic Details
http://www.sciencedirect.com/science/article/pii/S0022286019305356; http://dx.doi.org/10.1016/j.molstruc.2019.04.124; http://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&scp=85066433782&origin=inward; https://linkinghub.elsevier.com/retrieve/pii/S0022286019305356; https://api.elsevier.com/content/article/PII:S0022286019305356?httpAccept=text/xml; https://api.elsevier.com/content/article/PII:S0022286019305356?httpAccept=text/plain; https://dul.usage.elsevier.com/doi/; https://dx.doi.org/10.1016/j.molstruc.2019.04.124
Elsevier BV
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