2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate
In the title molecular salt, C6H10N3O+·C2F3O2−, the pyrimidinium cation is essentially planar, with a maximum deviation of 0.042 (3) Å for all non-H atoms. In the crystal, the cations and anions are linked via N—H...O hydrogen bonds, forming a centrosymmetric 2 + 2 aggregate with R22(8) and R42(8) r...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2016-06-01
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| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616010105 |
| _version_ | 1818273950104289280 |
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| author | Muthaiah Jeevaraj Bellarmin Edison Savaridasson Jose Kavitha Kanagasabapathy Thanikasalam Sebastian Britto Kasthuri Balasubramani |
| author_facet | Muthaiah Jeevaraj Bellarmin Edison Savaridasson Jose Kavitha Kanagasabapathy Thanikasalam Sebastian Britto Kasthuri Balasubramani |
| author_sort | Muthaiah Jeevaraj |
| collection | DOAJ |
| description | In the title molecular salt, C6H10N3O+·C2F3O2−, the pyrimidinium cation is essentially planar, with a maximum deviation of 0.042 (3) Å for all non-H atoms. In the crystal, the cations and anions are linked via N—H...O hydrogen bonds, forming a centrosymmetric 2 + 2 aggregate with R22(8) and R42(8) ring motifs. These motifs are further linked through a pair of C—H...O hydrogen bonds into a supramolecular tape along the [101] direction. |
| first_indexed | 2024-12-12T22:06:06Z |
| format | Article |
| id | doaj.art-a055852333e14eff8e609bc41e82015b |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-12T22:06:06Z |
| publishDate | 2016-06-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-a055852333e14eff8e609bc41e82015b2022-12-22T00:10:22ZengInternational Union of CrystallographyIUCrData2414-31462016-06-0116x16101010.1107/S2414314616010105su40552-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetateMuthaiah Jeevaraj0Bellarmin Edison1Savaridasson Jose Kavitha2Kanagasabapathy Thanikasalam3Sebastian Britto4Kasthuri Balasubramani5Department of Chemistry, Government Arts College (Autonomous), Thanthonimalai, Karur 639 005, Tamil Nadu, IndiaDepartment of Chemistry, Government Arts College (Autonomous), Thanthonimalai, Karur 639 005, Tamil Nadu, IndiaDepartment of Chemistry, Mother Teresa Women's University, Kodaikanal 624 102, Tamil Nadu, IndiaDepartment of Chemistry, Government Arts College, Tiruchirappalli 620 022, Tamil Nadu, IndiaDepartment of Chemistry, St. Joseph's College (Autonomous), Tiruchirappalli 620 002, Tamil Nadu, IndiaDepartment of Chemistry, Government Arts College (Autonomous), Thanthonimalai, Karur 639 005, Tamil Nadu, IndiaIn the title molecular salt, C6H10N3O+·C2F3O2−, the pyrimidinium cation is essentially planar, with a maximum deviation of 0.042 (3) Å for all non-H atoms. In the crystal, the cations and anions are linked via N—H...O hydrogen bonds, forming a centrosymmetric 2 + 2 aggregate with R22(8) and R42(8) ring motifs. These motifs are further linked through a pair of C—H...O hydrogen bonds into a supramolecular tape along the [101] direction.http://scripts.iucr.org/cgi-bin/paper?S2414314616010105crystal structuremolecular saltpyridiniumN—H...O hydrogen bondsC—H...O hydrogen bonds |
| spellingShingle | Muthaiah Jeevaraj Bellarmin Edison Savaridasson Jose Kavitha Kanagasabapathy Thanikasalam Sebastian Britto Kasthuri Balasubramani 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate IUCrData crystal structure molecular salt pyridinium N—H...O hydrogen bonds C—H...O hydrogen bonds |
| title | 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate |
| title_full | 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate |
| title_fullStr | 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate |
| title_full_unstemmed | 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate |
| title_short | 2-Amino-4-methoxy-6-methylpyrimidin-1-ium trifluoroacetate |
| title_sort | 2 amino 4 methoxy 6 methylpyrimidin 1 ium trifluoroacetate |
| topic | crystal structure molecular salt pyridinium N—H...O hydrogen bonds C—H...O hydrogen bonds |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616010105 |
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