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

diisopropylmercury   7893 Diisopropylmercury

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  7883 Mercury, dicationHg
  7884 Mercury, cationHg
  7885 Mercury, atomHg
  7886 Mercury hydride (Geo)HHg
  7887 Mercury hydrideHHg
  7888 MethylmercuryCH3Hg
  7889 Dimethylmercury, cationC2H6Hg
  7890 DimethylmercuryC2H6Hg
  7891 DiethylmercuryC4H10Hg
  7892 Di-n-propylmercuryC6H14Hg
  7893 Diisopropylmercury C6H14Hg
  7894 DiphenylmercuryC12H10Hg
  7895 Methylmercuric cyanide (Geo)C2H3NHg
  7896 Methylmercuric cyanideC2H3NHg
  7897 Hg(CN)2 (Geo)C2N2Hg
  7898 Mercuric cyanideC2N2Hg
  7899 Mercury oxide (Geo)OHg
  7900 Hg(II)CN(+) (BAVMUG) (Geo)C9H12NOHg
  7901 Hg(II)CN(+) (BAVMUG)C9H12NOHg
  7902 Hg(II)C2 (BEGVEO) (Geo)C8H6O2Hg
  7903 Hg(II)C2 (BEGVEO)C8H6O2Hg


ΔHf: 9.7 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
  
 PM7
Diisopropylmercury
 H=9.7 HR=C&P1970
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.53083667 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Hg     2.10644627 +1  111.9141474 +1    0.0000000 +0     2     1     0
  C     2.10659880 +1  180.0000000 +0  177.1976060 +1     3     2     1
  C     1.53068233 +1  111.9330654 +1   -7.1834835 +1     4     3     1
  H     1.09916802 +1  110.2280331 +1 -179.1820477 +1     5     4     3
  H     1.09633109 +1  112.7592305 +1   62.1119926 +1     5     4     3
  H     1.09587768 +1  112.7486914 +1  -60.4072357 +1     5     4     3
  H     1.11821990 +1  106.8565728 +1 -142.5928520 +1     4     3     7
  C     1.53110940 +1  111.8219821 +1   99.1460674 +1     4     3     7
  H     1.11852020 +1  106.8248848 +1  135.2387442 +1     2     3     7
  C     1.53072814 +1  111.9408653 +1 -106.4515060 +1     2     3     7
  H     1.09904397 +1  110.2310630 +1  178.3544283 +1     1     2     3
  H     1.09596903 +1  112.7777438 +1   59.5888263 +1     1     2     3
  H     1.09615931 +1  112.7811394 +1  -62.8798054 +1     1     2     3
  H     1.09903175 +1  110.2371741 +1  178.0043467 +1    10     4     3
  H     1.09597215 +1  112.7933137 +1   59.2362219 +1    10     4     3
  H     1.09614541 +1  112.7524287 +1  -63.2221058 +1    10     4     3
  H     1.09905899 +1  110.2343463 +1 -178.7606355 +1    12     2     3
  H     1.09614288 +1  112.7964133 +1   62.4731862 +1    12     2     3
  H     1.09598876 +1  112.7563595 +1  -60.0003486 +1    12     2     3