4.7 Article

On the entropy cost of making solvates

期刊

CHEMICAL COMMUNICATIONS
卷 56, 期 38, 页码 5127-5130

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ROYAL SOC CHEMISTRY
DOI: 10.1039/d0cc01050b

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资金

  1. Royal Society
  2. CCDC
  3. EPSRC
  4. 'Department of Excellence' Project of the Italian Ministry for Education, University and Research (MIUR)
  5. EPSRC [1934333] Funding Source: UKRI

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We present a simple way of estimating the entropy cost of solvate formation in crystals. The entropy penalty of making solvates can be as low as 9 kJ mol(-1) and is entirely dependent on the nature of the liquid component and the temperature of solvate formation. A link is found between a low entropy cost and a higher likelihood for a solvent to make solvates.

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