Cell Reactant:

Syringe Reactant:

Meas. Tech.:

ITC

Entry Date.:

12/08/10

pH:

7±0

Log₁₀Kb:

0.6

Temperature:

298.15±0 (K)

ΔH° :

-53±6 (kJ/mole)

ΔS° :

-0.148±0.02 (kJ/mole-K)

Comments:

First trial

Citation

 Kano, K; Nishiyabu, R; Doi, R Novel behavior of O-methylated beta-cyclodextrins in inclusion of meso-tetraarylporphyrins. J Org Chem 70:3667-73 (2005) [PubMed]  Article

More Info.:

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Source:

10016-20-3

Name:

BDBM4

Synonyms:

(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.2^{3,6}.2^{8,11}.2^{13,16}.2^{18,21}.2^{23,26}]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol | alpha-cyclodextrin

Type:

Molecular Host

Emp. Form.:

C36H60O30

Mol. Mass.:

972.8436

SMILES:

[H]C12OC(CO)C([H])(OC3([H])OC(CO)C([H])(OC4([H])OC(CO)C([H])(OC5([H])OC(CO)C([H])(OC6([H])OC(CO)C([H])(OC7([H])OC(CO)C([H])(O1)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O

Structure:

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Name:

BDBM36244

Synonyms:

5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin

Type:

Guest

Emp. Form.:

C50H30N4O12

Mol. Mass.:

878.7928

SMILES:

OC(=O)c1cc(cc(c1)-c1c2ccc(n2)c(-c2ccccc2)c2ccc(n2)c(-c2cc(cc(c2)C(O)=O)C(O)=O)c2ccc([nH]2)c(-c2cc(cc(c2)C(O)=O)C(O)=O)c2ccc1[nH]2)C(O)=O

Structure:

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