4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate
In the title compound, C10H12N6.C2H5OH, the planarity of the heterocyclic system is slightly distorted at the triazine ring (r.m.s. deviation = 0.1191 A), which adopts a conformation best described as intermediate between a flattened twisted boat and a half-boat with the tertiary Csp3 atom at the bo...
| Main Authors: | , , , , |
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| Format: | Journal Article |
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Blackwell Munksgaard
2011
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| Online Access: | http://hdl.handle.net/20.500.11937/6696 |
| _version_ | 1848745151914049536 |
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| author | Dolzhenko, Anton Tan, G. Dolzhenko, A. Koh, L. Chui, W. |
| author_facet | Dolzhenko, Anton Tan, G. Dolzhenko, A. Koh, L. Chui, W. |
| author_sort | Dolzhenko, Anton |
| building | Curtin Institutional Repository |
| collection | Online Access |
| description | In the title compound, C10H12N6.C2H5OH, the planarity of the heterocyclic system is slightly distorted at the triazine ring (r.m.s. deviation = 0.1191 A), which adopts a conformation best described as intermediate between a flattened twisted boat and a half-boat with the tertiary Csp3 atom at the bow. In the crystal, molecules form centrosymmetric dimers connected by N...H-O and O...H-N hydrogen bonds between the amino group H atom, the ethanol solvent molecule and the triazine N atom, making an R4 4(12) graph-set motif. The other H atom of the amino group and the H atom on the endocyclic N atom form N...H-N hydrogen bonds with the N atoms of the pyrazole and pyridine rings, respectively, linking the molecules into C(7)C(7) chains with the R2 2(8) binary graph-set motif running along [010]. |
| first_indexed | 2025-11-14T06:12:48Z |
| format | Journal Article |
| id | curtin-20.500.11937-6696 |
| institution | Curtin University Malaysia |
| institution_category | Local University |
| last_indexed | 2025-11-14T06:12:48Z |
| publishDate | 2011 |
| publisher | Blackwell Munksgaard |
| recordtype | eprints |
| repository_type | Digital Repository |
| spelling | curtin-20.500.11937-66962017-09-13T15:53:52Z 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate Dolzhenko, Anton Tan, G. Dolzhenko, A. Koh, L. Chui, W. X-ray crystallography triazines pyrazoles In the title compound, C10H12N6.C2H5OH, the planarity of the heterocyclic system is slightly distorted at the triazine ring (r.m.s. deviation = 0.1191 A), which adopts a conformation best described as intermediate between a flattened twisted boat and a half-boat with the tertiary Csp3 atom at the bow. In the crystal, molecules form centrosymmetric dimers connected by N...H-O and O...H-N hydrogen bonds between the amino group H atom, the ethanol solvent molecule and the triazine N atom, making an R4 4(12) graph-set motif. The other H atom of the amino group and the H atom on the endocyclic N atom form N...H-N hydrogen bonds with the N atoms of the pyrazole and pyridine rings, respectively, linking the molecules into C(7)C(7) chains with the R2 2(8) binary graph-set motif running along [010]. 2011 Journal Article http://hdl.handle.net/20.500.11937/6696 10.1107/S160053681005097X Blackwell Munksgaard fulltext |
| spellingShingle | X-ray crystallography triazines pyrazoles Dolzhenko, Anton Tan, G. Dolzhenko, A. Koh, L. Chui, W. 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title | 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title_full | 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title_fullStr | 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title_full_unstemmed | 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title_short | 4,4-Dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| title_sort | 4,4-dimethyl-3,4-dihydropyrido[2',3':3,4]pyrazolo[1,5-a ][1,3,5]triazin-2-amine ethanol monosolvate |
| topic | X-ray crystallography triazines pyrazoles |
| url | http://hdl.handle.net/20.500.11937/6696 |