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Cell Reactant:BDBM36273
Syringe Reactant:BDBM36274
Meas. Tech.:ITC
Entry Date:01/03/10
 
ΔG°:-29.3±0.0840 (kJ/mole)
pH:n/a
Log10Kb:5.12± 3.59
Temperature:298.15±0 (K)
ΔH° :-49.2±0.670 (kJ/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° : -0.0668±0.00240 (kJ/mole-K)
Comments:First trial
 
Citation Kumprecht, L; Budesí­nský, M; Vondrásek, J; Vymetal, J; Cerný, J; Cí­sarová, I; Brynda, J; Herzig, V; Koutní­k, P; Závada, J; Kraus, T Rigid duplex alpha-cyclodextrin reversibly connected with disulfide bonds. Synthesis and inclusion complexes. J Org Chem74:1082-92 (2009) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM36273
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36273
Synonyms:alpha-cyclodextrin dimer singly bridged dimer, 10
TypeMolecular Host
Emp. Form.C72H118O58S2
Mol. Mass.1975.803
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](CSSC[C@H]6O[C@@H]7O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@@H]%10[C@@H](CO)O[C@H](O[C@@H]%11[C@@H](CO)O[C@H](O[C@@H]%12[C@@H](CO)O[C@H](O[C@H]6[C@H](O)[C@H]7O)[C@H](O)[C@H]%12O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[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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BDBM36274
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36274
Synonyms:1,11-undecanediol
TypeGuest
Emp. Form.C11H24O2
Mol. Mass.188.3071
SMILESOCCCCCCCCCCCO
Structure
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