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Showing 10 out of a total of 12 results. (0.007 seconds)

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Crystallographic and Theoretical Evidence of Anion-π and Hydrogen‐Bonding Interactions in a Squaramide-Nitrate Salt

Rotger. C.; Soberats, B.; Quiñonero, D.; Frontera, A.; Balllester, P.; Benet-Buchholz, J.; Deyà, P.M.; Costa, A.
Synthesis, X-Ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion-Pi interactions

Orvay, F.; Bauzá, A.; Barceló-Oliver, M.; García-Raso, A.; Fiol, J.J.; Costa, A.; Molins, E.; Mata,I.; Frontera, A.
Quantification of aromaticity in oxocarbons: the problem of the fictitious nonaromatic reference system

Quiñonero, D.; Frontera, A.; Ballester, P.; Garau, C.; Costa, A.; Deyà, P.M.
A theoretical study of aromaticity in squaramide complexes with anions

Quiñonero, D.; Prohens, R.; Frontera, A.; Ballester, P.; Garau, C.; Costa, A.; Deyà, P.M.
Counterintuitive Interactions of Anions with Benzene Derivatives

Quiñonero, D.; Garau, C.; Frontera, A.; Ballester, P.; Costa, A.; Deyà, P.M.
Cation-pi versus Anion-pi Interactions: Energetic, Charge Transfer, and Aromatic Aspects

Garau, C.; Frontera, A.; Quiñonero, D.; Ballester, P.; Costa, A.; Deya, P.M.
DABCO‐Directed Self‐Assembly of Bisporphyrins (DABCO=1,4‐Diazabicyclo[2.2.2]octane)

Ballester, P.; Costa, A.; Castilla A.M.; Deyà, P.M.; Gomila R.M.; Frontera, A.; Hunter, C.A.
MP2 Study of Synergistic Effects Between X-H/pi (X=C,N,O) and pi-pi Interactions

Quiñonero, D.; Frontera, A.; Escudero, D.; Ballester, P.; Costa, A.; Deyà, P.M.
Ab initio Investigations of Lithium Diffusion in Single-Walled Carbon Nanotubes

Garau, C.; Frontera, A.; Quiñonero, D.; Ballester, P.; Costa, A.; Deya, P.M.
A Theoretical Ab Initio Study of the Capability of Several Binding Units for the Molecular Recognition of Anions

Frontera, A.; Garau, C.; Quiñonero, D.; Ballester, P.; Costa, A.; Deyà, P.M.

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