The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3
C14H11F3N6O3, orthorhombic, Pbca (no. 61), a = 8.08620(10) Å, b = 15.4730(2) Å, c = 23.5892(2) Å, V = 2951.43(6) Å3, Z = 8, R gt(F) = 0.0463, wR ref(F 2) = 0.1395, T = 293 K.
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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De Gruyter
2023-04-01
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| Series: | Zeitschrift für Kristallographie - New Crystal Structures |
| Subjects: | |
| Online Access: | https://doi.org/10.1515/ncrs-2023-0010 |
| _version_ | 1811159381599846400 |
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| author | Du Yi-Jing Sun Hong-Shun Wang Jian-Qiang Xu Jia-Ying |
| author_facet | Du Yi-Jing Sun Hong-Shun Wang Jian-Qiang Xu Jia-Ying |
| author_sort | Du Yi-Jing |
| collection | DOAJ |
| description | C14H11F3N6O3, orthorhombic, Pbca (no. 61), a = 8.08620(10) Å, b = 15.4730(2) Å, c = 23.5892(2) Å, V = 2951.43(6) Å3, Z = 8, R
gt(F) = 0.0463, wR
ref(F
2) = 0.1395, T = 293 K. |
| first_indexed | 2024-04-10T05:40:05Z |
| format | Article |
| id | doaj.art-8d71e295d8c8463893ee166a2d0125a6 |
| institution | Directory Open Access Journal |
| issn | 1433-7266 2197-4578 |
| language | English |
| last_indexed | 2024-04-10T05:40:05Z |
| publishDate | 2023-04-01 |
| publisher | De Gruyter |
| record_format | Article |
| series | Zeitschrift für Kristallographie - New Crystal Structures |
| spelling | doaj.art-8d71e295d8c8463893ee166a2d0125a62023-03-06T10:26:18ZengDe GruyterZeitschrift für Kristallographie - New Crystal Structures1433-72662197-45782023-04-01238233934010.1515/ncrs-2023-0010The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3Du Yi-Jing0Sun Hong-Shun1Wang Jian-Qiang2Xu Jia-Ying3College of Chemistry and Molecular Engineering, Nanjing Tech University, Nanjing211816, People’s Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing210048, People’s Republic of ChinaCollege of Chemistry and Molecular Engineering, Nanjing Tech University, Nanjing211816, People’s Republic of ChinaSchool of Chemistry and Chemical Engineering, Yancheng Institute of Technology, Yancheng224002, People’s Republic of ChinaC14H11F3N6O3, orthorhombic, Pbca (no. 61), a = 8.08620(10) Å, b = 15.4730(2) Å, c = 23.5892(2) Å, V = 2951.43(6) Å3, Z = 8, R gt(F) = 0.0463, wR ref(F 2) = 0.1395, T = 293 K.https://doi.org/10.1515/ncrs-2023-00102238122 |
| spellingShingle | Du Yi-Jing Sun Hong-Shun Wang Jian-Qiang Xu Jia-Ying The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 Zeitschrift für Kristallographie - New Crystal Structures 2238122 |
| title | The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 |
| title_full | The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 |
| title_fullStr | The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 |
| title_full_unstemmed | The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 |
| title_short | The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 |
| title_sort | crystal structure of 1 1 methyl 1h 1 2 4 triazol 3 yl methyl 3 2 4 5 trifluorobenzyl 1 3 5 triazinane 2 4 6 trione c14h11f3n6o3 |
| topic | 2238122 |
| url | https://doi.org/10.1515/ncrs-2023-0010 |
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