Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate
The crystal structure of the cluster complex salt, (C6H13N2)4[Nb6(NCS)6Cl12] or (H-DABCO)4[Nb6Cl12(NCS)6] (DABCO = triethylenediamine or 1,4-diazabicyclo[2.2.2]octane), comprises octahedral Nb6 cluster cores, which are μ2-coordinated by 12 chloride ligands (bridging the octahedral edges, inner ligan...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2023-05-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S241431462300398X |
| _version_ | 1797692241185079296 |
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| author | Eric Sperlich Martin Köckerling |
| author_facet | Eric Sperlich Martin Köckerling |
| author_sort | Eric Sperlich |
| collection | DOAJ |
| description | The crystal structure of the cluster complex salt, (C6H13N2)4[Nb6(NCS)6Cl12] or (H-DABCO)4[Nb6Cl12(NCS)6] (DABCO = triethylenediamine or 1,4-diazabicyclo[2.2.2]octane), comprises octahedral Nb6 cluster cores, which are μ2-coordinated by 12 chloride ligands (bridging the octahedral edges, inner ligand sphere). Furthermore, each Nb atom is N-bonded to a terminal thiocyanate ligand (outer ligand sphere). The discrete clusters carry a charge of −4, which is compensated by four monoprotonated DABCO molecules. These are arranged in rows, which are N—H...Cl and N—H...N hydrogen bonded to the anions and among each other. |
| first_indexed | 2024-03-12T02:25:45Z |
| format | Article |
| id | doaj.art-1b3dbf8cf11844d682958975aa3d1a62 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-03-12T02:25:45Z |
| publishDate | 2023-05-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-1b3dbf8cf11844d682958975aa3d1a622023-09-05T13:04:45ZengInternational Union of CrystallographyIUCrData2414-31462023-05-0185x23039810.1107/S241431462300398Xwm4186Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobateEric Sperlich0Martin Köckerling1Universität Potsdam, Institut für Chemie, Liebknecht-Str. 24-25, D-14476 Potsdam, GermanyUniversität Rostock, Institut für Chemie, Anorganische Festkörperchemie, Albert-Einstein-Str. 3a, D-18059 Rostock, GermanyThe crystal structure of the cluster complex salt, (C6H13N2)4[Nb6(NCS)6Cl12] or (H-DABCO)4[Nb6Cl12(NCS)6] (DABCO = triethylenediamine or 1,4-diazabicyclo[2.2.2]octane), comprises octahedral Nb6 cluster cores, which are μ2-coordinated by 12 chloride ligands (bridging the octahedral edges, inner ligand sphere). Furthermore, each Nb atom is N-bonded to a terminal thiocyanate ligand (outer ligand sphere). The discrete clusters carry a charge of −4, which is compensated by four monoprotonated DABCO molecules. These are arranged in rows, which are N—H...Cl and N—H...N hydrogen bonded to the anions and among each other.http://scripts.iucr.org/cgi-bin/paper?S241431462300398Xcrystal structureniobiumclusterchloridedabco |
| spellingShingle | Eric Sperlich Martin Köckerling Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate IUCrData crystal structure niobium cluster chloride dabco |
| title | Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate |
| title_full | Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate |
| title_fullStr | Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate |
| title_full_unstemmed | Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate |
| title_short | Tetrakis(triethylenediamin-1-ium) dodeca-μ2-chlorido-hexakis(thiocyanato-κN)hexa-octahedro-niobate |
| title_sort | tetrakis triethylenediamin 1 ium dodeca μ2 chlorido hexakis thiocyanato κn hexa octahedro niobate |
| topic | crystal structure niobium cluster chloride dabco |
| url | http://scripts.iucr.org/cgi-bin/paper?S241431462300398X |
| work_keys_str_mv | AT ericsperlich tetrakistriethylenediamin1iumdodecam2chloridohexakisthiocyanatoknhexaoctahedroniobate AT martinkockerling tetrakistriethylenediamin1iumdodecam2chloridohexakisthiocyanatoknhexaoctahedroniobate |