Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate
In the title compound, [Ba(C7H5N2O5)2(H2O)6]·4H2O, the Ba2+ cation lies on a twofold rotation axis and is ten-coordinated by two 3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanide oxo O atoms [Ba—O = 2.8715 (17) Å], two hydroxyimino N atoms [Ba&a...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2013-11-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536813027761 |
| _version_ | 1798030904533188608 |
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| author | Nguyen Dinh Do Olga Kovalchukova Adam Stash Svetlana Strashnova |
| author_facet | Nguyen Dinh Do Olga Kovalchukova Adam Stash Svetlana Strashnova |
| author_sort | Nguyen Dinh Do |
| collection | DOAJ |
| description | In the title compound, [Ba(C7H5N2O5)2(H2O)6]·4H2O, the Ba2+ cation lies on a twofold rotation axis and is ten-coordinated by two 3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanide oxo O atoms [Ba—O = 2.8715 (17) Å], two hydroxyimino N atoms [Ba—N = 3.036 (2) Å], and six water molecules [Ba—O = 2.847 (2), 2.848 (2), and 2.880 (2) Å]. The 3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanide monoanions act in a bidentate chelating manner, coordinating through an N atom of the non-deprotonated hydroxyimino group and an O atom of the neighboring oxo group. Two lattice water molecules are located in the cavities of the framework and are involved in hydrogen bonding to O atoms of one of the coordinating water molecules and the O atom of a keto group of the ligand. As a result, a three-dimensional network is formed. |
| first_indexed | 2024-04-11T19:47:43Z |
| format | Article |
| id | doaj.art-025c40395d0545d395822bc761c3a024 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-04-11T19:47:43Z |
| publishDate | 2013-11-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-025c40395d0545d395822bc761c3a0242022-12-22T04:06:23ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-11-016911m602m60310.1107/S1600536813027761Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrateNguyen Dinh DoOlga KovalchukovaAdam StashSvetlana StrashnovaIn the title compound, [Ba(C7H5N2O5)2(H2O)6]·4H2O, the Ba2+ cation lies on a twofold rotation axis and is ten-coordinated by two 3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanide oxo O atoms [Ba—O = 2.8715 (17) Å], two hydroxyimino N atoms [Ba—N = 3.036 (2) Å], and six water molecules [Ba—O = 2.847 (2), 2.848 (2), and 2.880 (2) Å]. The 3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanide monoanions act in a bidentate chelating manner, coordinating through an N atom of the non-deprotonated hydroxyimino group and an O atom of the neighboring oxo group. Two lattice water molecules are located in the cavities of the framework and are involved in hydrogen bonding to O atoms of one of the coordinating water molecules and the O atom of a keto group of the ligand. As a result, a three-dimensional network is formed.http://scripts.iucr.org/cgi-bin/paper?S1600536813027761 |
| spellingShingle | Nguyen Dinh Do Olga Kovalchukova Adam Stash Svetlana Strashnova Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate Acta Crystallographica Section E |
| title | Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate |
| title_full | Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate |
| title_fullStr | Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate |
| title_full_unstemmed | Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate |
| title_short | Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ2N3,O4]barium tetrahydrate |
| title_sort | hexaaquabis 3 5 bis hydroxyimino 1 methyl 2 4 6 trioxocyclohexanido 954 2n3 o4 barium tetrahydrate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536813027761 |
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