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1H-Pyrazole, 1-methyl-

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Reaction thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Robert C. Dunbar

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

Lithium ion (1+) + 1H-Pyrazole, 1-methyl- = (Lithium ion (1+) bullet 1H-Pyrazole, 1-methyl-)

By formula: Li+ + C4H6N2 = (Li+ bullet C4H6N2)

Quantity Value Units Method Reference Comment
Deltar49.5 ± 4.5kcal/molCIDTHuang and Rodgers, 2002 

Sodium ion (1+) + 1H-Pyrazole, 1-methyl- = (Sodium ion (1+) bullet 1H-Pyrazole, 1-methyl-)

By formula: Na+ + C4H6N2 = (Na+ bullet C4H6N2)

Quantity Value Units Method Reference Comment
Deltar31.4 ± 0.7kcal/molCIDTHuang and Rodgers, 2002 

Potassium ion (1+) + 1H-Pyrazole, 1-methyl- = (Potassium ion (1+) bullet 1H-Pyrazole, 1-methyl-)

By formula: K+ + C4H6N2 = (K+ bullet C4H6N2)

Quantity Value Units Method Reference Comment
Deltar22.5 ± 0.9kcal/molCIDTHuang and Rodgers, 2002 

References

Go To: Top, Reaction thermochemistry data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Huang and Rodgers, 2002
Huang, H.; Rodgers, M.T., Sigma versus Pi interactions in alkali metal ion binding to azoles: Threshold collision-induced dissociation and ab initio theory studies, J. Phys. Chem. A, 2002, 106, 16, 4277, https://doi.org/10.1021/jp013630b . [all data]


Notes

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