Accuracy

1-butyl iodide   1899 1-Butyl iodide

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    #  Species Formula
  1889 Hydrogen iodide (Geo)HI
  1890 Hydrogen iodideHI
  1891 Iodomethane (Geo)CH3I
  1892 Methyl iodideCH3I
  1893 IodoethaneC2H5I
  1894 3-Iodo-1-propeneC3H5I
  1895 E-1-Iodo-1-propeneC3H5I
  1896 Z-1-Iodo-1-propeneC3H5I
  1897 1-IodopropaneC3H7I
  1898 2-IodopropaneC3H7I
  1899 1-Butyl iodide C4H9I
  1900 Iodobenzene (Geo)C6H5I
  1901 IodobenzeneC6H5I
  1902 IodocyclohexaneC6H11I
  1903 Benzyl iodideC7H7I
  1904 m-IodotolueneC7H7I
  1905 o-IodotolueneC7H7I
  1906 p-IodotolueneC7H7I
  1907 1-IodonaphthaleneC10H7I
  1908 2-IodonaphthaleneC10H7I
  1909 Cyanogen iodideCNI


ΔHf: -12.0 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
I.P.: 9.2 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.
  

1-Butyl iodide
 I=9.2 H=-12.0 IR=LLNBS82 HR=C&P1970
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52768221 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.53811358 +1  110.5534232 +1    0.0000000 +0     2     1     0
  C     1.52257053 +1  109.4327708 +1  179.9696888 +1     3     2     1
  H     1.10154087 +1  111.6060001 +1   60.9108175 +1     4     3     2
  H     1.10155218 +1  111.6158981 +1  -60.7573489 +1     4     3     2
  I     2.16741896 +1  112.2008813 +1 -179.9216717 +1     4     3     2
 XX     1.00000000 +0  124.6196350 +0    0.0000000 +0     3     2     1
  H     1.10805462 +1   52.8111120 +1   89.0787189 +1     3     8     2
  H     1.10801427 +1   52.8241730 +1  -89.1034218 +1     3     8     2
 XX     1.00000000 +0  124.6196350 +0    0.0000000 +0     2     3     4
  H     1.10676831 +1   52.9490553 +1   90.2107097 +1     2    11     3
  H     1.10672704 +1   52.9664980 +1  -90.2437576 +1     2    11     3
  H     1.09603661 +1  111.5991406 +1  -60.0820330 +1     1     2     3
  H     1.09602876 +1  111.5889439 +1   60.2518183 +1     1     2     3
  H     1.09631749 +1  111.1634812 +1 -179.9189606 +1     1     2     3