3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate
In the title hydrated zwitterion, C10H13NO4·H2O, the N—C—C—OH side chain shows a gauche conformation [torsion angle = −59.05 (18)°]. In the crystal, the components are linked by O—H...O, N—H...O and C—H...O hydrogen bonds to generate a three-dimensional supramolecular network.
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2017-02-01
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| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314617002711 |
| _version_ | 1818253467209170944 |
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| author | Min Gao Li-Ping Lu |
| author_facet | Min Gao Li-Ping Lu |
| author_sort | Min Gao |
| collection | DOAJ |
| description | In the title hydrated zwitterion, C10H13NO4·H2O, the N—C—C—OH side chain shows a gauche conformation [torsion angle = −59.05 (18)°]. In the crystal, the components are linked by O—H...O, N—H...O and C—H...O hydrogen bonds to generate a three-dimensional supramolecular network. |
| first_indexed | 2024-12-12T16:40:32Z |
| format | Article |
| id | doaj.art-47daa02af0d6488f846946017f56c3ed |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-12T16:40:32Z |
| publishDate | 2017-02-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-47daa02af0d6488f846946017f56c3ed2022-12-22T00:18:34ZengInternational Union of CrystallographyIUCrData2414-31462017-02-0122x17027110.1107/S2414314617002711hb41243-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrateMin Gao0Li-Ping Lu1Institute of Molecular Science, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaInstitute of Molecular Science, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaIn the title hydrated zwitterion, C10H13NO4·H2O, the N—C—C—OH side chain shows a gauche conformation [torsion angle = −59.05 (18)°]. In the crystal, the components are linked by O—H...O, N—H...O and C—H...O hydrogen bonds to generate a three-dimensional supramolecular network.http://scripts.iucr.org/cgi-bin/paper?S2414314617002711crystal structurehydrate3-hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoateC—H...O hydrogen bondingO—H...O hydrogen bondingN—H...O hydrogen bondingsynchrotron |
| spellingShingle | Min Gao Li-Ping Lu 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate IUCrData crystal structure hydrate 3-hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate C—H...O hydrogen bonding O—H...O hydrogen bonding N—H...O hydrogen bonding synchrotron |
| title | 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate |
| title_full | 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate |
| title_fullStr | 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate |
| title_full_unstemmed | 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate |
| title_short | 3-Hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate monohydrate |
| title_sort | 3 hydroxy 2 4 hydroxybenzyl azaniumyl propanoate monohydrate |
| topic | crystal structure hydrate 3-hydroxy-2-[(4-hydroxybenzyl)azaniumyl]propanoate C—H...O hydrogen bonding O—H...O hydrogen bonding N—H...O hydrogen bonding synchrotron |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314617002711 |
| work_keys_str_mv | AT mingao 3hydroxy24hydroxybenzylazaniumylpropanoatemonohydrate AT lipinglu 3hydroxy24hydroxybenzylazaniumylpropanoatemonohydrate |