- Formula: C6H5N3
- Molecular weight: 119.1240
- IUPAC Standard InChI:
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- IUPAC Standard InChIKey: CTRLRINCMYICJO-UHFFFAOYSA-N
- CAS Registry Number: 622-37-7
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
- Other names: Azidobenzene; Benzene, triazo-; Phenyl azide
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Gas phase ion energetics data
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Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
|Proton affinity (review)||820.||kJ/mol||N/A||Hunter and Lias, 1998||HL|
|Gas basicity||787.5||kJ/mol||N/A||Hunter and Lias, 1998||HL|
Ionization energy determinations
|8.4||PE||Bastide, Maier, et al., 1976||LLK|
|8.72 ± 0.02||PE||Bastide, Maier, et al., 1976||Vertical value; LLK|
Go To: Top, Gas phase ion energetics data, Notes
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G., Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update, J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018 . [all data]
Bastide, Maier, et al., 1976
Bastide, J.; Maier, J.P.; Kubota, T., Ionisation energies and electronic structures of the phenyl 1,3-dipoles, J. Electron Spectrosc. Relat. Phenom., 1976, 9, 307. [all data]
Go To: Top, Gas phase ion energetics data, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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