Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network
The crystal structure of the title compound, [Ni3(C8H4O4)3(C3H7NO)4], is a two-dimensional coordination network formed by trinuclear linear Ni3(tp)3(DMF)4 units (tp = terephthalate = benzene-1,4-dicarboxylate and DMF = dimethylformamide) displaying a characteristic coordination mode of acetate group...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2019-12-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989019014658 |
| _version_ | 1819290809816580096 |
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| author | Cesario Ajpi Leopoldo Suescun Naviana Leiva Anders Lundblad Göran Lindbergh Saul Cabrera |
| author_facet | Cesario Ajpi Leopoldo Suescun Naviana Leiva Anders Lundblad Göran Lindbergh Saul Cabrera |
| author_sort | Cesario Ajpi |
| collection | DOAJ |
| description | The crystal structure of the title compound, [Ni3(C8H4O4)3(C3H7NO)4], is a two-dimensional coordination network formed by trinuclear linear Ni3(tp)3(DMF)4 units (tp = terephthalate = benzene-1,4-dicarboxylate and DMF = dimethylformamide) displaying a characteristic coordination mode of acetate groups in polynuclear metal–organic compounds. Individual trinuclear units are connected through tp anions in a triangular network that forms layers. One of the DMF ligands points outwards and provides interactions with equivalent planes above and below, leaving the second ligand in a structural void much larger than the DMF molecule, which shows positional disorder. Parallel planes are connected mainly through weak C—H...O, H...H and H...C interactions between DMF molecules, as shown by Hirshfeld surface analysis. |
| first_indexed | 2024-12-24T03:28:39Z |
| format | Article |
| id | doaj.art-7bab2cb010a84265b8415f170c2d4eae |
| institution | Directory Open Access Journal |
| issn | 2056-9890 |
| language | English |
| last_indexed | 2024-12-24T03:28:39Z |
| publishDate | 2019-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj.art-7bab2cb010a84265b8415f170c2d4eae2022-12-21T17:17:17ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902019-12-0175121839184310.1107/S2056989019014658ex2025Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination networkCesario Ajpi0Leopoldo Suescun1Naviana Leiva2Anders Lundblad3Göran Lindbergh4Saul Cabrera5Departament of Inorganic Chemistry and Materials Science/Advanced Materials, IIQ Chemical Research Institute, UMSA Universidad Mayor de San Andres, La Paz, BoliviaCryssmat-Lab/DETEMA, Facultad de Quimica, Universidad de la Republica, Montevideo, UruguayDepartament of Inorganic Chemistry and Materials Science/Advanced Materials, IIQ Chemical Research Institute, UMSA Universidad Mayor de San Andres, La Paz, BoliviaDivision of Safety and Transport/Electronics, RISE, Research Institutes of Sweden, SE-50462 Borås, SwedenDepartment of Chemical Engineering, Applied Electrochemistry, KTH Royal Institute of Technology, SE-100 44 Stockholm, SwedenDepartament of Inorganic Chemistry and Materials Science/Advanced Materials, IIQ Chemical Research Institute, UMSA Universidad Mayor de San Andres, La Paz, BoliviaThe crystal structure of the title compound, [Ni3(C8H4O4)3(C3H7NO)4], is a two-dimensional coordination network formed by trinuclear linear Ni3(tp)3(DMF)4 units (tp = terephthalate = benzene-1,4-dicarboxylate and DMF = dimethylformamide) displaying a characteristic coordination mode of acetate groups in polynuclear metal–organic compounds. Individual trinuclear units are connected through tp anions in a triangular network that forms layers. One of the DMF ligands points outwards and provides interactions with equivalent planes above and below, leaving the second ligand in a structural void much larger than the DMF molecule, which shows positional disorder. Parallel planes are connected mainly through weak C—H...O, H...H and H...C interactions between DMF molecules, as shown by Hirshfeld surface analysis.http://scripts.iucr.org/cgi-bin/paper?S2056989019014658crystal structureni metal-organic coordination networkterephthalatelayered structure |
| spellingShingle | Cesario Ajpi Leopoldo Suescun Naviana Leiva Anders Lundblad Göran Lindbergh Saul Cabrera Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network Acta Crystallographica Section E: Crystallographic Communications crystal structure ni metal-organic coordination network terephthalate layered structure |
| title | Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network |
| title_full | Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network |
| title_fullStr | Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network |
| title_full_unstemmed | Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network |
| title_short | Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network |
| title_sort | crystal structure and hirshfeld surface analysis of poly tris μ4 benzene 1 4 dicarboxylato tetrakis dimethylformamide trinickel ii a two dimensional coordination network |
| topic | crystal structure ni metal-organic coordination network terephthalate layered structure |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989019014658 |
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