(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)
The title compounds, [Ir(C14H12N2)(C11H8N)2]PF6 (1) and [Ir(C14H12N2)(C12H10N)2]PF6·0.61C2H10O·0.78CH3CN (2), crystallize in the space groups Pbca and P1, respectively, each structure containing one monocationic Ir complex and one PF6− anion in the asymmetric unit. The anion and solvent in compound...
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International Union of Crystallography
2025-02-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
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| Online Access: | https://journals.iucr.org/paper?S2056989024012039 |
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| author | Trevor J. Gienau Malachi Clay William W. Brennessel Carly R. Reed |
| author_facet | Trevor J. Gienau Malachi Clay William W. Brennessel Carly R. Reed |
| author_sort | Trevor J. Gienau |
| collection | DOAJ |
| description | The title compounds, [Ir(C14H12N2)(C11H8N)2]PF6 (1) and [Ir(C14H12N2)(C12H10N)2]PF6·0.61C2H10O·0.78CH3CN (2), crystallize in the space groups Pbca and P1, respectively, each structure containing one monocationic Ir complex and one PF6− anion in the asymmetric unit. The anion and solvent in compound 2 are disordered. The Ir—N(phenanthroline) bond lengths of ca. 2.21 Å indicate a greater steric effect of the 2,9-dimethyl-1,10-phenanthroline ligand compared to 1,10-phenanthroline. Both structures show offset parallel intermolecular π–π interactions between the pyridine rings of the phenanthroline ligands, and that of 1 also exhibits similar interactions between the phenyl and pyridine rings of the phenylpyridine ligands. |
| format | Article |
| id | doaj-art-74742bc35d4d49c9a5046a59e3cb37d4 |
| institution | Kabale University |
| issn | 2056-9890 |
| language | English |
| publishDate | 2025-02-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj-art-74742bc35d4d49c9a5046a59e3cb37d42025-02-06T07:27:16ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902025-02-0181212713110.1107/S2056989024012039zv2036(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)Trevor J. Gienau0Malachi Clay1William W. Brennessel2Carly R. Reed3Department of Chemistry and Biochemistry, State University of New York at Brockport, Brockport, NY 14420, USADepartment of Chemistry and Biochemistry, State University of New York at Brockport, Brockport, NY 14420, USADepartment of Chemistry, 120 Trustee Road, University of Rochester, Rochester, NY 14627, USADepartment of Chemistry and Biochemistry, State University of New York at Brockport, Brockport, NY 14420, USAThe title compounds, [Ir(C14H12N2)(C11H8N)2]PF6 (1) and [Ir(C14H12N2)(C12H10N)2]PF6·0.61C2H10O·0.78CH3CN (2), crystallize in the space groups Pbca and P1, respectively, each structure containing one monocationic Ir complex and one PF6− anion in the asymmetric unit. The anion and solvent in compound 2 are disordered. The Ir—N(phenanthroline) bond lengths of ca. 2.21 Å indicate a greater steric effect of the 2,9-dimethyl-1,10-phenanthroline ligand compared to 1,10-phenanthroline. Both structures show offset parallel intermolecular π–π interactions between the pyridine rings of the phenanthroline ligands, and that of 1 also exhibits similar interactions between the phenyl and pyridine rings of the phenylpyridine ligands.https://journals.iucr.org/paper?S2056989024012039crystal structureiridium2-phenylpyridine2-(4-methylphenyl)pyridine2,9-dimethyl-1,10-phenanthroline |
| spellingShingle | Trevor J. Gienau Malachi Clay William W. Brennessel Carly R. Reed (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) Acta Crystallographica Section E: Crystallographic Communications crystal structure iridium 2-phenylpyridine 2-(4-methylphenyl)pyridine 2,9-dimethyl-1,10-phenanthroline |
| title | (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) |
| title_full | (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) |
| title_fullStr | (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) |
| title_full_unstemmed | (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) |
| title_short | (2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78) |
| title_sort | 2 9 dimethyl 1 10 phenanthroline bis 2 pyridin 2 yl phenyl iridium iii hexafluorophosphate and 2 9 dimethyl 1 10 phenanthroline bis 5 methyl 2 pyridin 2 yl phenyl iridium iii hexafluorophosphate diethyl ether acetonitrile 1 0 61 0 78 |
| topic | crystal structure iridium 2-phenylpyridine 2-(4-methylphenyl)pyridine 2,9-dimethyl-1,10-phenanthroline |
| url | https://journals.iucr.org/paper?S2056989024012039 |
| work_keys_str_mv | AT trevorjgienau 29dimethyl110phenanthrolinebis2pyridin2ylphenyliridiumiiihexafluorophosphateand29dimethyl110phenanthrolinebis5methyl2pyridin2ylphenyliridiumiiihexafluorophosphatediethyletheracetonitrile1061078 AT malachiclay 29dimethyl110phenanthrolinebis2pyridin2ylphenyliridiumiiihexafluorophosphateand29dimethyl110phenanthrolinebis5methyl2pyridin2ylphenyliridiumiiihexafluorophosphatediethyletheracetonitrile1061078 AT williamwbrennessel 29dimethyl110phenanthrolinebis2pyridin2ylphenyliridiumiiihexafluorophosphateand29dimethyl110phenanthrolinebis5methyl2pyridin2ylphenyliridiumiiihexafluorophosphatediethyletheracetonitrile1061078 AT carlyrreed 29dimethyl110phenanthrolinebis2pyridin2ylphenyliridiumiiihexafluorophosphateand29dimethyl110phenanthrolinebis5methyl2pyridin2ylphenyliridiumiiihexafluorophosphatediethyletheracetonitrile1061078 |