Naphthalene, 1-chloro-

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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: John E. Bartmess

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Individual Reactions

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1594. ± 8.4kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes
Quantity Value Units Method Reference Comment
Δr1561. ± 8.8kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1621. ± 9.6kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes
Quantity Value Units Method Reference Comment
Δr1589. ± 10.kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1610. ± 15.kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes
Quantity Value Units Method Reference Comment
Δr1577. ± 16.kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes

Gas phase ion energetics data

Go To: Top, Reaction thermochemistry data, References, Notes

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:
B - John E. Bartmess
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard

Electron affinity determinations

EA (eV) Method Reference Comment
0.2771 ± 0.0035ECDSteelhammer and Wentworth, 1969B

Ionization energy determinations

IE (eV) Method Reference Comment
8.13PEKlasinc, Kovac, et al., 1983LBLHLM

De-protonation reactions

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1594. ± 8.4kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B
Quantity Value Units Method Reference Comment
Δr1561. ± 8.8kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1621. ± 9.6kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B
Quantity Value Units Method Reference Comment
Δr1589. ± 10.kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B

C10H6Cl- + Hydrogen cation = Naphthalene, 1-chloro-

By formula: C10H6Cl- + H+ = C10H7Cl

Quantity Value Units Method Reference Comment
Δr1610. ± 15.kJ/molBranWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B
Quantity Value Units Method Reference Comment
Δr1577. ± 16.kJ/molH-TSWenthold and Squires, 1995gas phase; By HO- cleavage of substituted silanes; B

References

Go To: Top, Reaction thermochemistry data, Gas phase ion energetics data, Notes

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

Wenthold and Squires, 1995
Wenthold, P.G.; Squires, R.R., Determination of the gas-phase acidities of halogen-substituted aromatic compounds using the silane-cleavage method, J. Mass Spectrom., 1995, 30, 1, 17, https://doi.org/10.1002/jms.1190300105 . [all data]

Steelhammer and Wentworth, 1969
Steelhammer, J.C.; Wentworth, W.E., Correlation of Electron Beam and Thermal Electron Attachment Studies for Some Chloro, Bromo, Iodo Aromatic Compounds, J. Chem. Phys., 1969, 51, 5, 1802, https://doi.org/10.1063/1.1672262 . [all data]

Klasinc, Kovac, et al., 1983
Klasinc, L.; Kovac, B.; Gusten, H., Photoelectron spectra of acenes. Electronic structure and substituent effects, Pure Appl. Chem., 1983, 55, 289. [all data]


Notes

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