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

lic3h7r    101 Isopropyl lithium (Geo)

(Previous)     (Back)     (Next)        

   

    #  Species Formula
    91 Propenyl, cationC3H5
    92 AllylC3H5
    93 Cyclopropane (Geo)C3H6
    94 CyclopropaneC3H6
    95 PropeneC3H6
    96 Propene (Geo)C3H6
    97 i-Propyl radicalC3H7
    98 PropaneC3H8
    99 Propane (Geo)C3H8
   100 Isopropyl lithiumH7LiC3
   101 Isopropyl lithium (Geo) H7LiC3
   102 Trimethyborane (Geo)H9BC3
   103 TrimethylboraneH9BC3
   104 Carbon, tetramerC4
   105 Diacetylene (Geo)C4H2
   106 DiacetyleneC4H2
   107 CH2=C=C=CH2 (Geo)C4H4
   108 CH2=C=C=CH2C4H4
   109 Vinylacetylene (Geo)C4H4
   110 VinylacetyleneC4H4
   111 1,2-ButadieneC4H6


REF: M. Sana, G. Leroy, and C. Wilante, Organometallics, 10, 264 (1991)
  
 PM7
Isopropyl lithium
 <Li-C> GR=SLW1991
 Li     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.03700000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.07416178 +1  108.3626306 +1    0.0000000 +0     2     1     0
  H     1.07346521 +1  105.2487977 +1  120.0000000 +0     2     1     3
  C     1.50832307 +1  104.8089309 +1 -120.0178786 +1     2     1     3
  H     1.10776552 +1  109.9696703 +1  120.0000000 +0     5     2     1
  H     1.10530580 +1  113.4349307 +1    0.0000000 +0     5     2     1
  C     1.55327416 +1  112.3556857 +1 -120.0000000 +0     5     2     1
  H     1.09133164 +1  111.3692621 +1  120.0000000 +0     8     5     2
  H     1.09316601 +1  111.4189766 +1    0.0000000 +0     8     5     2
  H     1.09205037 +1  111.0345217 +1 -120.0000000 +0     8     5     2