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4,7-Phenanthrolinium perchlorate-5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one-water (1/1/2)
dc.contributor.author | Caballero Hernández, Ana Belén | |
dc.contributor.author | Quirós Olozábal, Miguel | |
dc.contributor.author | Salas Peregrín, Juan Manuel | |
dc.date.accessioned | 2014-09-24T09:24:09Z | |
dc.date.available | 2014-09-24T09:24:09Z | |
dc.date.issued | 2010 | |
dc.identifier.citation | Caballero, A.B.; Quirós, M.; Salas, J.M. 4,7-Phenanthrolinium perchlorate-5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one-water (1/1/2). Acta Crystallographica Seciton E - Structure Reports Online, 66: O459-O460 (2010). [http://hdl.handle.net/10481/33165] | es_ES |
dc.identifier.issn | 1600-5368 | |
dc.identifier.uri | http://hdl.handle.net/10481/33165 | |
dc.description.abstract | The asymmetric unit of the title compound, C12H9N2+·ClO4-·C6H6N4O·2H2O, contains a monoprotonated 4,7-phenanthrolinium (47phen) cation, a perchlorate anion balancing its charge, a neutral molecule of 5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one (HmtpO) and two interstitial water molecules. In the crystal structure, the acidic H atoms of 47phenH+ and HmtpO form strong hydrogen bonds with the water molecules, which in turn act as hydrogen-bond donors, forming links between them and towards the carbonyl O atom of HmtpO, the non-protonated N atom of 47phen+ and one of the O atoms of the anion. | es_ES |
dc.description.sponsorship | We acknowledge financial support from the Spanish Ministerio de Ciencia y Tecnología (project CTQ2008–00037/PPQ) and from the Junta de Andalucía (research group FQM 195). ABC is grateful for a FPU grant from the Spanish Ministerio de Educación y Ciencia. | es_ES |
dc.language.iso | eng | es_ES |
dc.publisher | International Union of Crystallography | es_ES |
dc.subject | Perchlorate | es_ES |
dc.subject | Crystal | es_ES |
dc.title | 4,7-Phenanthrolinium perchlorate-5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one-water (1/1/2) | es_ES |
dc.type | info:eu-repo/semantics/article | es_ES |
dc.rights.accessRights | info:eu-repo/semantics/openAccess | es_ES |
dc.identifier.doi | 10.1107/S1600536810002564 |