Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate
The reaction of o-phenylenediamine (OPD), sodium naphthalene1,5-disulfonate (Na2NDS) and nickel sulfate in an ethanol–water mixture yielded the title compound, [Ni(OPD)2(H2O)2]·NDS or [Ni(C6H8N2)2(H2O)2](C10H6O6S2). This salt consists of a complex [Ni(OPD)2(H2O)2]2+ cation with two bidentate OPD lig...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2023-11-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989023009350 |
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| author | Jabbor R Suyunov Khayit Kh. Turaev Bekmurod Kh. Alimnazarov Yusuf E. Nazarov Islombek J. Mengnorov Bakhtiyar T. Ibragimov Jamshid M. Ashurov |
| author_facet | Jabbor R Suyunov Khayit Kh. Turaev Bekmurod Kh. Alimnazarov Yusuf E. Nazarov Islombek J. Mengnorov Bakhtiyar T. Ibragimov Jamshid M. Ashurov |
| author_sort | Jabbor R Suyunov |
| collection | DOAJ |
| description | The reaction of o-phenylenediamine (OPD), sodium naphthalene1,5-disulfonate (Na2NDS) and nickel sulfate in an ethanol–water mixture yielded the title compound, [Ni(OPD)2(H2O)2]·NDS or [Ni(C6H8N2)2(H2O)2](C10H6O6S2). This salt consists of a complex [Ni(OPD)2(H2O)2]2+ cation with two bidentate OPD ligands and trans aqua ligands, and a non-coordinating NDS2– anion, which is the double-deprotonated form of H2NDS. The NiII atom is situated at a center of inversion and exhibits a slightly tetragonally distorted {O2N4} octahedral coordination environment, with four shorter equatorial Ni—N bonds [2.0775 (17) and 2.0924 (18) Å] and a longer axial Ni—O bond [2.1381 (17) Å]. The OPD ligand is located about an inversion center and is nearly coplanar with the NiN4 plane [dihedral angle 0.95 (9)°]. In the crystal, the cations and anions are connected by charge-assisted intermolecular N—H...O and O—H...O hydrogen-bonding interactions into the tri-periodic network structure. Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H...H (44.1%), O...H/H...O (34.3%), C...H/H...C (14.8%) C...C (6.5%) (involving the cations) and O...H/H...O (50%), H...H (25%), C...H/H...C (15.3%), C...C (8.2%) (involving the anions) interactions. |
| first_indexed | 2024-03-11T12:23:53Z |
| format | Article |
| id | doaj.art-85d5394f6cc74bf48acba7593dc755f6 |
| institution | Directory Open Access Journal |
| issn | 2056-9890 |
| language | English |
| last_indexed | 2024-03-11T12:23:53Z |
| publishDate | 2023-11-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj.art-85d5394f6cc74bf48acba7593dc755f62023-11-06T14:46:42ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902023-11-0179111083108710.1107/S2056989023009350wm5701Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonateJabbor R Suyunov0Khayit Kh. Turaev1Bekmurod Kh. Alimnazarov2Yusuf E. Nazarov3Islombek J. Mengnorov4Bakhtiyar T. Ibragimov5Jamshid M. Ashurov6Termez State University, "Barkamol avlod", at street, 43., Termez city, UzbekistanTermez State University, "Barkamol avlod", at street, 43., Termez city, UzbekistanTermez State University, "Barkamol avlod", at street, 43., Termez city, UzbekistanTermez State University, "Barkamol avlod", at street, 43., Termez city, UzbekistanInstitute of Bioorganic Chemistry, Academy of Sciences of Uzbekistan, 100125, M. Ulugbek Str 83, Tashkent, UzbekistanInstitute of Bioorganic Chemistry, Academy of Sciences of Uzbekistan, 100125, M. Ulugbek Str 83, Tashkent, UzbekistanInstitute of Bioorganic Chemistry, Academy of Sciences of Uzbekistan, 100125, M. Ulugbek Str 83, Tashkent, UzbekistanThe reaction of o-phenylenediamine (OPD), sodium naphthalene1,5-disulfonate (Na2NDS) and nickel sulfate in an ethanol–water mixture yielded the title compound, [Ni(OPD)2(H2O)2]·NDS or [Ni(C6H8N2)2(H2O)2](C10H6O6S2). This salt consists of a complex [Ni(OPD)2(H2O)2]2+ cation with two bidentate OPD ligands and trans aqua ligands, and a non-coordinating NDS2– anion, which is the double-deprotonated form of H2NDS. The NiII atom is situated at a center of inversion and exhibits a slightly tetragonally distorted {O2N4} octahedral coordination environment, with four shorter equatorial Ni—N bonds [2.0775 (17) and 2.0924 (18) Å] and a longer axial Ni—O bond [2.1381 (17) Å]. The OPD ligand is located about an inversion center and is nearly coplanar with the NiN4 plane [dihedral angle 0.95 (9)°]. In the crystal, the cations and anions are connected by charge-assisted intermolecular N—H...O and O—H...O hydrogen-bonding interactions into the tri-periodic network structure. Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H...H (44.1%), O...H/H...O (34.3%), C...H/H...C (14.8%) C...C (6.5%) (involving the cations) and O...H/H...O (50%), H...H (25%), C...H/H...C (15.3%), C...C (8.2%) (involving the anions) interactions.http://scripts.iucr.org/cgi-bin/paper?S2056989023009350o-phenylenediamine1,5-naphthalenedisulfonic acidcrystal structureintermolecular interactionshydrogen bondinghirshfeld surface |
| spellingShingle | Jabbor R Suyunov Khayit Kh. Turaev Bekmurod Kh. Alimnazarov Yusuf E. Nazarov Islombek J. Mengnorov Bakhtiyar T. Ibragimov Jamshid M. Ashurov Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate Acta Crystallographica Section E: Crystallographic Communications o-phenylenediamine 1,5-naphthalenedisulfonic acid crystal structure intermolecular interactions hydrogen bonding hirshfeld surface |
| title | Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate |
| title_full | Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate |
| title_fullStr | Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate |
| title_full_unstemmed | Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate |
| title_short | Synthesis, crystal structure and Hirshfeld surface analysis of diaquabis(o-phenylenediamine-κ2N,N′)nickel(II) naphthalene-1,5-disulfonate |
| title_sort | synthesis crystal structure and hirshfeld surface analysis of diaquabis o phenylenediamine κ2n n nickel ii naphthalene 1 5 disulfonate |
| topic | o-phenylenediamine 1,5-naphthalenedisulfonic acid crystal structure intermolecular interactions hydrogen bonding hirshfeld surface |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989023009350 |
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