Accuracy

cyclopropenyl, cation     24 Cyclopropenyl, cation

(Previous)     (Back)     (Next)         Geometry predicted using PM7

    

    #  Species Formula
    14 Vinyl, cationC2H3
    15 VinylC2H3
    16 Ethylene, cationC2H4
    17 Ethylene (Geo)C2H4
    18 EthyleneC2H4
    19 MethylmethyleneC2H4
    20 Ethyl, cationC2H5
    21 Ethyl radicalC2H5
    22 Ethane (Geo)C2H6
    23 Carbon, trimerC3
    24 Cyclopropenyl, cation C3H3
    25 Propynyl, cationC3H3
    26 AlleneC3H4
    27 Allene (Geo)C3H4
    28 Cyclopropene (Geo)C3H4
    29 CyclopropeneC3H4
    30 PropyneC3H4
    31 Propyne (Geo)C3H4
    32 Allyl, cationC3H5
    33 Cyclopropyl, cationC3H5
    34 Propenyl, cationC3H5


ΔHf: 257.0 kcal/mol,     REF: H. Halim, N. Heinrich, W. Koch, J. Schmidt, G. Frenking, J. Comp. Chem., 7, 93 (1986), references therein.
  
 CHARGE=1
Cyclopropenyl, cation
 H=257 HR=HHKS1986
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.38827345 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.38835800 +1   59.9903526 +1    0.0000000 +0     1     2     0
  H     1.07541326 +1  150.0155036 +1  179.9999973 +1     1     2     3
  H     1.07548930 +1  149.9644795 +1 -179.9997830 +1     2     1     3
  H     1.07550550 +1  149.9752618 +1 -179.9997222 +1     3     1     2