Cell Reactant:
BDBM11
Syringe Reactant:
BDBM36209
Meas. Tech.:
ITC
Entry Date.:
12/08/10
pH:
7.2±0
Temperature:
298.15±0 (K)
ΔH° :
-7.51±0.1 (kJ/mole)
ΔS° :
-0.01±n/a (kJ/mole-K)
Comments:
First trial
Citation
 Eftink, MRAndy, MLBystrom, KPerlmutter, HDKristol, DS Cyclodextrin Inclusion Complexes: Studies of the Variation in the Size of Alicyclic Guests J Am Chem Soc 111:6765-72 (1989)    Article
Cell React
Source:
7585-39-9
Name:
BDBM11
Synonyms:
beta-cyclodextrin | betadex
Type:
Molecular Host
Emp. Form.:
C42H70O35
Mol. Mass.:
1134.9842
SMILES:
[H][C@]1(CO)O[C@]2([H])O[C@]3([H])[C@@]([H])(CO)O[C@]([H])(O[C@]4([H])[C@@]([H])(CO)O[C@]([H])(O[C@]5([H])[C@@]([H])(CO)O[C@]([H])(O[C@]6([H])[C@@]([H])(CO)O[C@]([H])(O[C@]7([H])[C@@]([H])(CO)O[C@]([H])(O[C@]8([H])[C@@]([H])(CO)O[C@]([H])(O[C@@]1([H])[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@@]8([H])O)[C@]([H])(O)[C@@]7([H])O)[C@]([H])(O)[C@@]6([H])O)[C@]([H])(O)[C@@]5([H])O)[C@]([H])(O)[C@@]4([H])O)[C@]([H])(O)[C@@]3([H])O
Structure:
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Syringe React
Name:
BDBM36209
Synonyms:
3-homoadamantanecarboxylate (3HAC)
Type:
Guest
Emp. Form.:
C12H18O2
Mol. Mass.:
194.2701
SMILES:
OC(=O)C12CC3CC(CC(C3)CC1)C2 |TLB:1:3:6:10.9.8,10:5:13:9.8.11.12,10:9:13:6.5.4,THB:11:9:6:3.13.4,12:3:6:10.9.8|
Structure:
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