Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate
In the title compound, [Mn(C8H3NO6)(C8H7N3)2(H2O)]·0.5H2O, the Mn2+ ion is octahedrally coordinated by two 2-(1H-pyrazol-3-yl)pyridine ligands, one 4-nitrophthalate ligand and one coordinated water molecule leading to an overall MnN4O2 coordination environment. The two 2-(1H-pyrazol-3-y...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2010-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536810045952 |
| _version_ | 1819279757312786432 |
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| author | Lei Ni Hong Wei Ji-Li Zhao |
| author_facet | Lei Ni Hong Wei Ji-Li Zhao |
| author_sort | Lei Ni |
| collection | DOAJ |
| description | In the title compound, [Mn(C8H3NO6)(C8H7N3)2(H2O)]·0.5H2O, the Mn2+ ion is octahedrally coordinated by two 2-(1H-pyrazol-3-yl)pyridine ligands, one 4-nitrophthalate ligand and one coordinated water molecule leading to an overall MnN4O2 coordination environment. The two 2-(1H-pyrazol-3-yl)pyridine ligands, which deviate from planarity by 0.0187 (2) and 0.0601 (2) Å, make a dihedral angle of 81.90 (6)°. An intramolecular N—H...O hydrogen bond occurs. Intermolecular π–π stacking interactions with a face-to-face separation of 3.61 (1) Å between the 2-(1H-pyrazol-3-yl)pyridine ligands is observed. Additionally, O—H...O hydrogen bonding involving the uncoordinated water (which is situated on an inversion center), coordinated water molecules and 2-(1H-pyrazol-3-yl)pyridine ligands leads to a three-dimensional network in the crystal structure. |
| first_indexed | 2024-12-24T00:32:58Z |
| format | Article |
| id | doaj.art-0ed08d52945848ab91f5435a197cf41b |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-24T00:32:58Z |
| publishDate | 2010-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-0ed08d52945848ab91f5435a197cf41b2022-12-21T17:24:12ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682010-12-016612m1550m155010.1107/S1600536810045952Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrateLei NiHong WeiJi-Li ZhaoIn the title compound, [Mn(C8H3NO6)(C8H7N3)2(H2O)]·0.5H2O, the Mn2+ ion is octahedrally coordinated by two 2-(1H-pyrazol-3-yl)pyridine ligands, one 4-nitrophthalate ligand and one coordinated water molecule leading to an overall MnN4O2 coordination environment. The two 2-(1H-pyrazol-3-yl)pyridine ligands, which deviate from planarity by 0.0187 (2) and 0.0601 (2) Å, make a dihedral angle of 81.90 (6)°. An intramolecular N—H...O hydrogen bond occurs. Intermolecular π–π stacking interactions with a face-to-face separation of 3.61 (1) Å between the 2-(1H-pyrazol-3-yl)pyridine ligands is observed. Additionally, O—H...O hydrogen bonding involving the uncoordinated water (which is situated on an inversion center), coordinated water molecules and 2-(1H-pyrazol-3-yl)pyridine ligands leads to a three-dimensional network in the crystal structure.http://scripts.iucr.org/cgi-bin/paper?S1600536810045952 |
| spellingShingle | Lei Ni Hong Wei Ji-Li Zhao Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate Acta Crystallographica Section E |
| title | Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate |
| title_full | Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate |
| title_fullStr | Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate |
| title_full_unstemmed | Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate |
| title_short | Aqua(4-nitrophthalato-κO1)bis[2-(1H-pyrazol-3-yl-κN2)pyridine-κN]manganese(II) hemihydrate |
| title_sort | aqua 4 nitrophthalato amp 954 o1 bis 2 1h pyrazol 3 yl amp 954 n2 pyridine amp 954 n manganese ii hemihydrate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536810045952 |
| work_keys_str_mv | AT leini aqua4nitrophthalatoamp954o1bis21hpyrazol3ylamp954n2pyridineamp954nmanganeseiihemihydrate AT hongwei aqua4nitrophthalatoamp954o1bis21hpyrazol3ylamp954n2pyridineamp954nmanganeseiihemihydrate AT jilizhao aqua4nitrophthalatoamp954o1bis21hpyrazol3ylamp954n2pyridineamp954nmanganeseiihemihydrate |