N-Glycylglycine

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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 as indicated in comments:
RCD - Robert C. Dunbar
B - John E. Bartmess

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

Sodium ion (1+) + N-Glycylglycine = (Sodium ion (1+) • N-Glycylglycine)

By formula: Na+ + C4H8N2O3 = (Na+ • C4H8N2O3)

Quantity Value Units Method Reference Comment
Δr42.3 ± 1.7kcal/molCIDCCerda, Hoyau, et al., 1998See amide; RCD
Δr42.9kcal/molCIDTKlassen, Anderson, et al., 1996RCD

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
34.20.CIDCFeng, Gronert, et al., 1999RCD

CAS Reg. No. 23372-53-4 + N-Glycylglycine = C8H15N4O6-

By formula: CAS Reg. No. 23372-53-4 + C4H8N2O3 = C8H15N4O6-

Quantity Value Units Method Reference Comment
Δr7.50 ± 0.30kcal/molTDEqLiu, Wyttenbacj, et al., 2004gas phase; B
Quantity Value Units Method Reference Comment
Δr3.12kcal/molTDEqLiu, Wyttenbacj, et al., 2004gas phase; B

References

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

Cerda, Hoyau, et al., 1998
Cerda, B.A.; Hoyau, S.; Ohanessian, G.; Wesdemiotis, C., PAs of Peptides, J. Am. Chem. Soc., 1998, 120, 2437. [all data]

Klassen, Anderson, et al., 1996
Klassen, J.S.; Anderson, S.G.; Blades, A.T.; Kebarle, P., Reaction Enthalpies for M+L = M+ + L, Where M+ = Na+ and K+ and L = Acetamide, N-Methylacetamide, N,N-Dimethylacetamide, Glycine, and Glycylglycine, from Determinations of the Collision-Induced Dissociation Thresholds, J. Phys. Chem., 1996, 100, 33, 14218, https://doi.org/10.1021/jp9608382 . [all data]

Feng, Gronert, et al., 1999
Feng, W.Y.; Gronert, S.; Lebrilla, C.B., Lithium and sodium ion binding energies of N-acetyl and N-glycyl amino acids, J. Am. Chem. Soc., 1999, 121, 6, 1365, https://doi.org/10.1021/ja983116s . [all data]

Liu, Wyttenbacj, et al., 2004
Liu, D.; Wyttenbacj, T.; Carpenter, C.J.; Bowers, M.T., Investigation of Non-Covalent Interactions in Deprotonated Peptides: Structural and Energetic Competition between Aggregation and Hydration, J. Am. Chem. Soc., 2004, 126, 10, 3261, https://doi.org/10.1021/ja0393628 . [all data]


Notes

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