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Pregled bibliografske jedinice broj: 486450

Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study

Čičak, Helena; Vančik, Hrvoj; Mihalić, Zlatko
Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study // Journal of organic chemistry, 75 (2010), 20; 6969-6972 doi:10.1021/jo101185n (međunarodna recenzija, članak, znanstveni)

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Naslov
Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study

Autori
Čičak, Helena ; Vančik, Hrvoj ; Mihalić, Zlatko

Izvornik
Journal of organic chemistry (0022-3263) 75 (2010), 20; 6969-6972

Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni

Ključne riječi
trimethylsilylacetylenes; matrix isolation; antimony acetylides; silyl cations; quantum-mechanical calculations

Sažetak
Reaction of trimethylsilylacetylenes Me3SiC≡CR with SbF5 in the solid state was investigated using matrix isolation infrared spectroscopy and quantum-mechanical calculations. Two reaction pathways were detected. Replacement of the trimethylsilyl group with SbF4 produces neutral antimony acetylides F4SbC≡CR. Acetylenic bond protonation produces silyl cation 6-R, fully bridged for R = H and SiMe3. High total charges on the bridging SiMe3 group and low Me3Si−C bond orders to acetylenic moiety, both calculated at the MP4(SDQ)/6-311G(d, p) level of theory, indicate high silyl cation character of these species.

Izvorni jezik
Engleski

Znanstvena područja
Kemija



POVEZANOST RADA

Projekti:
119-1191342-1334 - Reakcije organskih spojeva u čvrstom stanju: mehanizmi i supramolekulski inženje (Vančik, Hrvoj, MZOS ) ( CroRIS)
119-1191342-1339 - Molekulsko modeliranje strukture i reaktivnosti organskih spojeva (Mihalić, Zlatko, MZOS ) ( CroRIS)

Ustanove:
Prirodoslovno-matematički fakultet, Zagreb

Profili:

Avatar Url Zlatko Mihalić (autor)

Avatar Url Helena Čičak (autor)

Avatar Url Hrvoj Vančik (autor)

Poveznice na cjeloviti tekst rada:

doi

Citiraj ovu publikaciju:

Čičak, Helena; Vančik, Hrvoj; Mihalić, Zlatko
Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study // Journal of organic chemistry, 75 (2010), 20; 6969-6972 doi:10.1021/jo101185n (međunarodna recenzija, članak, znanstveni)
Čičak, H., Vančik, H. & Mihalić, Z. (2010) Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study. Journal of organic chemistry, 75 (20), 6969-6972 doi:10.1021/jo101185n.
@article{article, author = {\v{C}i\v{c}ak, Helena and Van\v{c}ik, Hrvoj and Mihali\'{c}, Zlatko}, year = {2010}, pages = {6969-6972}, DOI = {10.1021/jo101185n}, keywords = {trimethylsilylacetylenes, matrix isolation, antimony acetylides, silyl cations, quantum-mechanical calculations}, journal = {Journal of organic chemistry}, doi = {10.1021/jo101185n}, volume = {75}, number = {20}, issn = {0022-3263}, title = {Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study}, keyword = {trimethylsilylacetylenes, matrix isolation, antimony acetylides, silyl cations, quantum-mechanical calculations} }
@article{article, author = {\v{C}i\v{c}ak, Helena and Van\v{c}ik, Hrvoj and Mihali\'{c}, Zlatko}, year = {2010}, pages = {6969-6972}, DOI = {10.1021/jo101185n}, keywords = {trimethylsilylacetylenes, matrix isolation, antimony acetylides, silyl cations, quantum-mechanical calculations}, journal = {Journal of organic chemistry}, doi = {10.1021/jo101185n}, volume = {75}, number = {20}, issn = {0022-3263}, title = {Reaction of Trimethylsilylacetylenes with Antimony Pentafluoride under Matrix Isolation Conditions: Experimental and Computational Study}, keyword = {trimethylsilylacetylenes, matrix isolation, antimony acetylides, silyl cations, quantum-mechanical calculations} }

Časopis indeksira:


  • Current Contents Connect (CCC)
  • Web of Science Core Collection (WoSCC)
    • Science Citation Index Expanded (SCI-EXP)
    • SCI-EXP, SSCI i/ili A&HCI
  • Scopus
  • MEDLINE

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