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Pregled bibliografske jedinice broj: 369953

Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations


Glasovac, Zoran; Vazdar, Mario; Margetić, Davor
Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations // Croatica Chemica Acta, 82 (2009), 1; 63-70 (međunarodna recenzija, članak, znanstveni)


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Naslov
Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations

Autori
Glasovac, Zoran ; Vazdar, Mario ; Margetić, Davor

Izvornik
Croatica Chemica Acta (0011-1643) 82 (2009), 1; 63-70

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

Ključne riječi
DFT calculations; NICS; TDDFT; proton affinity; basicity

Sažetak
Quantum-chemical calculations were used to investigate molecular and electronic properties of porphyrin and subporphyrin.

Izvorni jezik
Engleski

Znanstvena područja
Kemija



POVEZANOST RADA


Projekti:
098-0982933-2920 - Organski i bioorganski procesi u osnovnom i elektronski pobuđenim stanjima (Maksić, Mirjana, MZOS ) ( POIROT)
098-0982933-3218 - Host-guest međudjelovanja u policikličkim sustavima (Margetić, Davor, MZOS ) ( POIROT)

Ustanove:
Institut "Ruđer Bošković", Zagreb

Profili:

Avatar Url Davor Margetić (autor)

Avatar Url Mario Vazdar (autor)

Avatar Url Zoran Glasovac (autor)

Poveznice na cjeloviti tekst rada:

Hrčak Hrčak

Citiraj ovu publikaciju:

Glasovac, Zoran; Vazdar, Mario; Margetić, Davor
Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations // Croatica Chemica Acta, 82 (2009), 1; 63-70 (međunarodna recenzija, članak, znanstveni)
Glasovac, Z., Vazdar, M. & Margetić, D. (2009) Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations. Croatica Chemica Acta, 82 (1), 63-70.
@article{article, author = {Glasovac, Zoran and Vazdar, Mario and Margeti\'{c}, Davor}, year = {2009}, pages = {63-70}, keywords = {DFT calculations, NICS, TDDFT, proton affinity, basicity}, journal = {Croatica Chemica Acta}, volume = {82}, number = {1}, issn = {0011-1643}, title = {Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations}, keyword = {DFT calculations, NICS, TDDFT, proton affinity, basicity} }
@article{article, author = {Glasovac, Zoran and Vazdar, Mario and Margeti\'{c}, Davor}, year = {2009}, pages = {63-70}, keywords = {DFT calculations, NICS, TDDFT, proton affinity, basicity}, journal = {Croatica Chemica Acta}, volume = {82}, number = {1}, issn = {0011-1643}, title = {Proton affinities of didehydroporphyrin and subporphyrin in ground and excited states obtained by quantum chemical calculations}, keyword = {DFT calculations, NICS, TDDFT, proton affinity, basicity} }

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





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