Fluorodinitrophenylmethane

• Formula: C₇H₅FN₂O₄
• Molecular weight: 200.1240
• IUPAC Standard InChI: InChI=1S/C7H5FN2O4/c8-7(9(11)12,10(13)14)6-4-2-1-3-5-6/h1-5H Copy

  
• IUPAC Standard InChIKey: NPRRCIKUIFRPTB-UHFFFAOYSA-N Copy
• CAS Registry Number: 17003-70-2
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Fluorodinitrophenylethane
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• Information on this page:
  • Gas phase thermochemistry data
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Phase change data
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Gas phase 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:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

References

Go To: Top, Gas phase thermochemistry data, Notes

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

Stewart, 2004
Stewart, J.J.P., Comparison of the accuracy of semiempirical and some DFT methods for predicting heats of formation, J. Mol. Model, 2004, 10, 1, 6-10, https://doi.org/10.1007/s00894-003-0157-6 . [all data]

Pepekin, Matyushin, et al., 1972
Pepekin, V.I.; Matyushin, Yu.N.; Rozantsev, G.G.; Shevelev, S.A.; Apin, A.Ya., Enthalpies of formation of dinitrophenylmethane, trinitrophenylethane, and fluorodinitrophenylamine, Bull. Acad. Sci. USSR, Div. Chem. Sci., 1972, 2634-2636. [all data]

Notes

Go To: Top, Gas phase thermochemistry data, References

• Symbols used in this document:
  

  ΔfH°gas

  Enthalpy of formation of gas at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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