PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

iodomethyl methyl ether   5846 Iodomethyl methyl ether

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  5836 o-IodotolueneC7H7I
  5837 ortho IodotolueneC7H7I
  5838 p-IodotolueneC7H7I
  5839 1-IodonaphthaleneC10H7I
  5840 2-IodonaphthaleneC10H7I
  5841 Cyanogen iodideCNI
  5842 Li(I)N3I (JEPRUR) (Geo)H15LiC15N3I
  5843 Li(I)N3I (JEPRUR)H15LiC15N3I
  5844 Iodine oxideOI
  5845 Acetyl iodideC2H3OI
  5846 Iodomethyl methyl ether C2H5OI
  5847 1-Iodo-2-propanoneC3H5OI
  5848 3-Iodo-2-butanoneC4H7OI
  5849 Benzoyl iodideC7H5OI
  5850 Nitrosyl iodideNOI
  5851 2-Iodobenzoic acidC7H5O2I
  5852 3-Iodobenzoic acidC7H5O2I
  5853 4-Iodobenzoic acidC7H5O2I
  5854 Li(I)O4I (HARCEI) (Geo)H20LiC8O4I
  5855 Li(I)O4I (HARCEI)H20LiC8O4I
  5856 Li(+)(H2O)5.IH10LiO5I


ΔHf: -29.3 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.
  
 PM7
Iodomethyl methyl ether
 H=-29.3 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  H     1.09655054 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.10317001 +1  113.1831174 +1    0.0000000 +0     1     2     0
  O     1.38445549 +1  113.6880789 +1 -118.0740226 +1     1     2     3
  I     2.20416520 +1  106.2830329 +1 -125.5102687 +1     1     2     4
  H     2.08181208 +1   98.6133569 +1  -16.6370766 +1     4     1     2
  H     1.80301607 +1   64.5017766 +1  -96.8339133 +1     6     4     1
  C     1.09452807 +1   34.4497548 +1  -35.3718947 +1     7     6     4
  H     1.09924290 +1  109.9278047 +1 -122.5399414 +1     8     7     6