Accuracy
 ethylene phosphate anion r 
 
  1990 Ethylene phosphate anion (Geo)
  
   
 (Previous)    
 
 (Back)     
   
 (Next)         
  REF:  Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 CHARGE=-1 PM7
Ethylene phosphate anion
 <P-O> <><> <><><> <P=O> GR=PW91D
  P     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.51186200 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.58155679 +1  115.9676905 +1    0.0000000 +0     1     2     0
  C     1.55325687 +1   72.4692667 +1   99.0631100 +1     3     1     2
  O     1.42198100 +1   36.4800591 +1  179.0097367 +1     3     1     4
  O     1.47854070 +1  123.2081396 +1 -160.3825881 +1     1     2     3
  O     1.42223184 +1  109.0037105 +1    0.0491056 +1     4     3     1
  H     1.10516117 +1  121.3368951 +1   74.7891639 +1     3     1     5
  H     1.10489384 +1  122.2949425 +1 -147.7016528 +1     3     1     8
  H     1.10509270 +1  112.6500882 +1  117.8066609 +1     4     3     7
  H     1.10503712 +1  112.6750446 +1  124.3443112 +1     4     3    10