Through-Space Spin-Spin Coupling In Acetylenic Systems. Ab Initio and DFT Calculations

doi:10.3390/i4040193

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Int. J. Mol. Sci. 2003, 4(4), 193-202; doi:10.3390/i4040193

Article

Through-Space Spin-Spin Coupling In Acetylenic Systems. Ab Initio and DFT Calculations

Alessandro Bagno^1,* , Girolamo Casella², Giacomo Saielli¹ and Gianfranco Scorrano¹

¹ Istituto per la Tecnologia delle Membrane del CNR, Sezione di Padova, Dipartimento di Chimica Organica, Università di Padova, Via Marzolo 1, 35131 Padova, Italy ² Dipartimento di Chimica Inorganica e Analitica "Stanislao Cannizzaro", Università di Palermo, Viale delle Scienze Parco d'Orleans II, 90128 Palermo, Italy

* Author to whom correspondence should be addressed.

Received: 30 September 2002 / Accepted: 5 November 2002 / Published: 4 April 2003

(This article belongs to the Special Issue Nuclear Magnetic Resonance Spin-Spin Coupling Constants - Calculations and Measurements - Part II)

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Keywords: Through-space coupling; NMR; ab initio; DFT

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MDPI and ACS Style

Bagno, A.; Casella, G.; Saielli, G.; Scorrano, G. Through-Space Spin-Spin Coupling In Acetylenic Systems. Ab Initio and DFT Calculations. Int. J. Mol. Sci. 2003, 4, 193-202.

AMA Style

Bagno A, Casella G, Saielli G, Scorrano G. Through-Space Spin-Spin Coupling In Acetylenic Systems. Ab Initio and DFT Calculations. International Journal of Molecular Sciences. 2003; 4(4):193-202.

Chicago/Turabian Style

Bagno, Alessandro; Casella, Girolamo; Saielli, Giacomo; Scorrano, Gianfranco. 2003. "Through-Space Spin-Spin Coupling In Acetylenic Systems. Ab Initio and DFT Calculations." Int. J. Mol. Sci. 4, no. 4: 193-202.

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