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Cell Reactant:BDBM36267
Syringe Reactant:BDBM36265
Meas. Tech.:ITC
Entry Date:01/03/11
 
ΔG°:-6.21±0.0200 (kcal/mole)
pH:7.2±0
Log10Kb:4.55± 3.07
Temperature:298.15±0 (K)
ΔH° :-4.61±0 (kcal/mole)
ΔHobs:n/a
Ionic Strength:n/a
Corrected for ΔHioniz:n/a
Protons Released:n/a
ΔCp :n/a
Stoich. Param.:n/a
ΔS° :0.0100±0 (kcal/mole-K)
Comments:First trial
 
Citation Liu, YYang, ECYang, YWZhang, HYFan, ZDing, FCao, R Thermodynamics of the molecular and chiral recognition of cycloalkanols and camphor by modified beta-cyclodextrins possessing simple aromatic tethers. J Org Chem69:173-80 (2004) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM36267
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36267
Synonyms:6-O-phenyl-beta-cyclodextrin
TypeMolecular Host
Emp. Form.C48H74O35
Mol. Mass.1211.0802
SMILESOC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](COc7ccccc7)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O
Structure
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BDBM36265
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36265
Synonyms:(+)-borneol
TypeGuest
Emp. Form.C10H18O
Mol. Mass.154.2493
SMILESCC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O)C2 |THB:9:8:1:4.5|
Structure
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