Accuracy

3-bromopropene   1832 3-Bromopropene

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

    

    #  Species Formula
  1822 Hexachloro-1,3,5,2,4,6-triazatriphosphorineN3P3Cl6
  1823 Hydrogen bromide, cationHBr
  1824 Hydrogen bromide (Geo)HBr
  1825 Hydrogen bromideHBr
  1826 BromomethaneCH3Br
  1827 Bromomethane (Geo)CH3Br
  1828 BromoacetyleneHC2Br
  1829 Bromoacetylene (Geo)HC2Br
  1830 BromoethyleneC2H3Br
  1831 BromoethaneC2H5Br
  1832 3-Bromopropene C3H5Br
  1833 1-BromopropaneC3H7Br
  1834 2-BromopropaneC3H7Br
  1835 BromobenzeneC6H5Br
  1836 1-BromonaphthaleneC10H7Br
  1837 2-BromonaphthaleneC10H7Br
  1838 1-Bromo-dodecaneC12H25Br
  1839 1-Bromo-hexadecaneC16H33Br
  1840 Cyanogen bromide (Geo)CNBr
  1841 Cyanogen bromideCNBr
  1842 3-Bromo-3-methyldiazirineC2H3N2Br


ΔHf: 10.9 kcal/mol,     REF: D. C. Frost, C. A. McDowell, D. A. Vroom, J. Chem. Phys., 46, 4255 (1967).
  
 SYMMETRY
3-Bromopropene
 H=10.9 HR=FMV1967
 
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.33124638 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.48494054 +1  127.5165060 +1    0.0000000 +0     2     1     0
 XX     5.00000000 +0  127.6917036 +1  180.0000000 +0     3     2     1
 Br     1.95850904 +1  115.1907068 +1    0.0000000 +0     3     2     1
  H     1.10678480 +1   54.1440725 +1   90.0000000 +0     3     4     5
  H     1.10678480 +0   54.1440725 +0  -90.0000000 +0     3     4     5
  H     1.09665915 +1  120.5005415 +1  180.0000000 +0     2     1     3
  H     1.08071678 +1  122.9094872 +1  180.0000000 +0     1     2     3
  H     1.07925794 +1  125.2723255 +1    0.0000000 +0     1     2     3
 
   6  1    7
   6  2    7