{"page":"9534-9539","language":[{"iso":"eng"}],"publication":"Angewandte Chemie International Edition","status":"public","_id":"41010","article_type":"original","user_id":"48467","year":"2021","citation":{"apa":"Watt, F. A., Burkhardt, L., Schoch, R., Mitzinger, S., Bauer, M., Weigend, F., Goicoechea, J. M., Tambornino, F., &#38; Hohloch, S. (2021). η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**. <i>Angewandte Chemie International Edition</i>, <i>60</i>(17), 9534–9539. <a href=\"https://doi.org/10.1002/anie.202100559\">https://doi.org/10.1002/anie.202100559</a>","chicago":"Watt, Fabian A., Lukas Burkhardt, Roland Schoch, Stefan Mitzinger, Matthias Bauer, Florian Weigend, Jose M. Goicoechea, Frank Tambornino, and Stephan Hohloch. “η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**.” <i>Angewandte Chemie International Edition</i> 60, no. 17 (2021): 9534–39. <a href=\"https://doi.org/10.1002/anie.202100559\">https://doi.org/10.1002/anie.202100559</a>.","mla":"Watt, Fabian A., et al. “η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**.” <i>Angewandte Chemie International Edition</i>, vol. 60, no. 17, Wiley, 2021, pp. 9534–39, doi:<a href=\"https://doi.org/10.1002/anie.202100559\">10.1002/anie.202100559</a>.","ama":"Watt FA, Burkhardt L, Schoch R, et al. η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**. <i>Angewandte Chemie International Edition</i>. 2021;60(17):9534-9539. doi:<a href=\"https://doi.org/10.1002/anie.202100559\">10.1002/anie.202100559</a>","ieee":"F. A. Watt <i>et al.</i>, “η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**,” <i>Angewandte Chemie International Edition</i>, vol. 60, no. 17, pp. 9534–9539, 2021, doi: <a href=\"https://doi.org/10.1002/anie.202100559\">10.1002/anie.202100559</a>.","bibtex":"@article{Watt_Burkhardt_Schoch_Mitzinger_Bauer_Weigend_Goicoechea_Tambornino_Hohloch_2021, title={η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**}, volume={60}, DOI={<a href=\"https://doi.org/10.1002/anie.202100559\">10.1002/anie.202100559</a>}, number={17}, journal={Angewandte Chemie International Edition}, publisher={Wiley}, author={Watt, Fabian A. and Burkhardt, Lukas and Schoch, Roland and Mitzinger, Stefan and Bauer, Matthias and Weigend, Florian and Goicoechea, Jose M. and Tambornino, Frank and Hohloch, Stephan}, year={2021}, pages={9534–9539} }","short":"F.A. Watt, L. Burkhardt, R. Schoch, S. Mitzinger, M. Bauer, F. Weigend, J.M. Goicoechea, F. Tambornino, S. Hohloch, Angewandte Chemie International Edition 60 (2021) 9534–9539."},"type":"journal_article","keyword":["General Chemistry","Catalysis"],"publisher":"Wiley","issue":"17","intvolume":"        60","date_updated":"2023-01-31T08:06:50Z","title":"η            <sup>3</sup>            ‐Coordination and Functionalization of the 2‐Phosphaethynthiolate Anion at Lanthanum(III)**","abstract":[{"text":"We present the η3-coordination of the 2-phosphaethynthiolate anion in the complex (PN)2La(SCP) (2) [PN=N-(2-(diisopropylphosphanyl)-4-methylphenyl)-2,4,6-trimethylanilide)]. Structural comparison with dinuclear thiocyanate-bridged (PN)2La(μ-1,3-SCN)2La(PN)2 (3) and azide-bridged (PN)2La(μ-1,3-N3)2La(PN)2 (4) complexes indicates that the [SCP]− coordination mode is mainly governed by electronic, rather than steric factors. Quantum mechanical investigations reveal large contributions of the antibonding π*-orbital of the [SCP]− ligand to the LUMO of complex 2, rendering it the ideal precursor for the first functionalization of the [SCP]− anion. Complex 2 was therefore reacted with CAACs which induced a selective rearrangement of the [SCP]− ligand to form the first CAAC stabilized group 15–group 16 fulminate-type complexes (PN)2La{SPC(RCAAC)} (5 a,b, R=Ad, Me). A detailed reaction mechanism for the SCP-to-SPC isomerization is proposed based on DFT calculations.","lang":"eng"}],"publication_status":"published","date_created":"2023-01-30T17:00:21Z","doi":"10.1002/anie.202100559","publication_identifier":{"issn":["1433-7851","1521-3773"]},"author":[{"first_name":"Fabian A.","full_name":"Watt, Fabian A.","last_name":"Watt"},{"first_name":"Lukas","full_name":"Burkhardt, Lukas","last_name":"Burkhardt"},{"full_name":"Schoch, Roland","last_name":"Schoch","id":"48467","first_name":"Roland","orcid":"0000-0003-2061-7289"},{"last_name":"Mitzinger","full_name":"Mitzinger, Stefan","first_name":"Stefan"},{"first_name":"Matthias","id":"47241","full_name":"Bauer, Matthias","last_name":"Bauer","orcid":"0000-0002-9294-6076"},{"first_name":"Florian","last_name":"Weigend","full_name":"Weigend, Florian"},{"first_name":"Jose M.","full_name":"Goicoechea, Jose M.","last_name":"Goicoechea"},{"first_name":"Frank","last_name":"Tambornino","full_name":"Tambornino, Frank"},{"last_name":"Hohloch","full_name":"Hohloch, Stephan","first_name":"Stephan"}],"volume":60,"department":[{"_id":"35"},{"_id":"306"}]}