QSPR ensemble modelling of alkaline-earth metal complexation

QSPR ensemble modeling of the stability constant log  K of the complexes of Mg 2+ , Ca 2+ , Sr 2+ and Ba 2+ with diverse 273 (Mg 2+ ), 284 (Ca 2+ ), 147 (Sr 2+ ) and 198 (Ba 2+ ) organic ligands in water for the M 2+  + L = (M 2+ )L equilibrium at 298 K and an ionic strength 0.1 M has been performed...

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Veröffentlicht in:	Journal of Inclusion Phenomena and Macrocyclic Chemistry 2013-06, Vol.76 (1-2), p.159-171
Hauptverfasser:	Solov’ev, V. P., Kireeva, N., Tsivadze, A. Yu, Varnek, A.
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemical Sciences Chemistry Chemistry and Materials Science Crystallography and Scattering Methods Food Science or physical chemistry Organic Chemistry Original Article Theoretical and
Online-Zugang:	Volltext
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