Accuracy

p-iodotoluene   1906 p-Iodotoluene

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    #  Species Formula
  1896 Z-1-Iodo-1-propeneC3H5I
  1897 1-IodopropaneC3H7I
  1898 2-IodopropaneC3H7I
  1899 1-Butyl iodideC4H9I
  1900 Iodobenzene (Geo)C6H5I
  1901 IodobenzeneC6H5I
  1902 IodocyclohexaneC6H11I
  1903 Benzyl iodideC7H7I
  1904 m-IodotolueneC7H7I
  1905 o-IodotolueneC7H7I
  1906 p-Iodotoluene C7H7I
  1907 1-IodonaphthaleneC10H7I
  1908 2-IodonaphthaleneC10H7I
  1909 Cyanogen iodideCNI
  1910 Acetyl iodideC2H3OI
  1911 Iodomethyl methyl etherC2H5OI
  1912 1-Iodo-2-propanoneC3H5OI
  1913 3-Iodo-2-butanoneC4H7OI
  1914 Benzoyl iodideC7H5OI
  1915 Nitrosyl iodideNOI
  1916 2-Iodobenzoic acidC7H5O2I


ΔHf: 29.1 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  

p-Iodotoluene
 H=29.1 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.39131707 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.39379072 +1  119.1310169 +1    0.0000000 +0     2     1     0
  C     1.39647091 +1  120.3892347 +1    0.0386390 +1     3     2     1
  C     1.39824774 +1  119.6071423 +1    0.0058535 +1     4     3     2
  C     1.39234373 +1  120.4792726 +1   -0.0157948 +1     5     4     3
  I     2.11416288 +1  119.3499621 +1  179.9876430 +1     1     2     3
  H     2.15072699 +1  131.2141951 +1 -147.0870294 +1     4     3     5
  H     1.76958576 +1   65.6845414 +1 -112.5493530 +1     8     4     3
  C     1.10048732 +1   36.5031856 +1   36.9732753 +1     9     8     4
  H     1.08901991 +1  119.8351387 +1  179.9935453 +1     5     4     6
  H     1.09030502 +1  119.2294520 +1  179.9963063 +1     6     5     4
  H     1.09840010 +1  106.9900419 +1  114.3451844 +1    10     9     8
  H     1.08887129 +1  119.5506258 +1  179.9899691 +1     3     2     4
  H     1.09046672 +1  121.7131918 +1 -179.9894366 +1     2     1     3