Accuracy

methyl nitrite   1046 Methyl nitrite

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    #  Species Formula
  1036 XanthoneC13H8O2
  1037 Phenyl benzoateC13H10O2
  1038 9,10-AnthroquinoneC14H8O2
  1039 9,10-PhenanthroquinoneC14H8O2
  1040 Nitrogen dioxideNO2
  1041 Nitrogen dioxide (Geo)NO2
  1042 Nitrous acid (cis)(https://aip.scitation.org/doi/10.1063/1.1696387) (Geo)HNO2
  1043 Nitrous acid (trans) (https://aip.scitation.org/doi/10.1063/1.1696387) (Geo)HNO2
  1044 Nitrous acid, cisHNO2
  1045 Nitrous acid, transHNO2
  1046 Methyl nitrite CH3NO2
  1047 NitromethaneCH3NO2
  1048 Ethyl nitriteC2H5NO2
  1049 GlycineC2H5NO2
  1050 Methyl carbamateC2H5NO2
  1051 NitroethaneC2H5NO2
  1052 AlanineC3H7NO2
  1053 beta-AlanineC3H7NO2
  1054 IsopropylnitriteC3H7NO2
  1055 N-MethylglycineC3H7NO2
  1056 Propyl nitriteC3H7NO2


ΔHf: -15.8 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
I.P.: 11.0 eV,     REF: R. D. Levin, S. G. Lias, "Ionization Potentials and Appearance Potential Measurements," 1971-1981, Natl. Stand. Ref. Data Ser., Natl. Bur. Stand. 71, (1982), Cat. No. C13.48:71.
  

Methyl nitrite
 HR=C&P1970 H=-15.8 I=11.0 IR=LLNBS82
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.42752568 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     1.38365473 +1  110.4093682 +1    0.0000000 +0     2     1     0
  O     1.17619130 +1  111.7634174 +1 -179.9910952 +1     3     2     1
  H     1.09783405 +1  102.4736197 +1 -179.9383993 +1     1     2     3
  H     1.09447702 +1  110.9060752 +1   61.8324237 +1     1     2     3
  H     1.09448765 +1  110.9232749 +1  -61.6973816 +1     1     2     3