Accuracy

2-chloro-2-methylpropane   2349 2-Chloro-2-methylpropane

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

   

    #  Species Formula
  2339 Chloroethane (Geo)C2H5Cl
  2340 ChloroethaneC2H5Cl
  2341 DimethylchloroboraneH6BC2Cl
  2342 2-ChloropropeneC3H5Cl
  2343 2-Chloropropene (Geo)C3H5Cl
  2344 1-ChloropropaneC3H7Cl
  2345 1-Chloropropane (Geo)C3H7Cl
  2346 2-ChloropropaneC3H7Cl
  2347 2-Chloropropane (Geo)C3H7Cl
  2348 1-Chloro-2-methylpropaneC4H9Cl
  2349 2-Chloro-2-methylpropane C4H9Cl
  2350 2-Chloro-2-methylpropane (Geo)C4H9Cl
  2351 1-ChloropentaneC5H11Cl
  2352 Be(II)(Cp)Cl (JEFKIO) (Geo)H5BeC5Cl
  2353 Be(II)(Cp)Cl (JEFKIO)H5BeC5Cl
  2354 Cyclo C5H5 beryllium chloride (Geo)H5BeC5Cl
  2355 ChlorobenzeneC6H5Cl
  2356 Chlorobenzene (Geo)C6H5Cl
  2357 Benzyl chlorideC7H7Cl
  2358 1-Chloro-4-ethylbenzeneC8H9Cl
  2359 1-ChloronaphthaleneC10H7Cl


ΔHf: -43.0 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
2-Chloro-2-methylpropane
 H=-43.0 HR=NIST
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.82361856 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.51668566 +1  105.8616384 +1    0.0000000 +0     2     1     0
  C     1.51660151 +1  105.8549420 +1  119.9996165 +1     2     1     3
  C     1.51667654 +1  105.8509171 +1  119.9652493 +1     2     1     4
  H     1.09755617 +1  111.2573805 +1  179.9309442 +1     3     2     1
  H     1.09941888 +1  112.1192652 +1  120.0500897 +1     3     2     6
  H     1.09962059 +1  112.0981342 +1  120.0281168 +1     3     2     7
  H     1.09940660 +1  112.1269926 +1   59.9137755 +1     4     2     1
  H     1.09776037 +1  111.2238933 +1  119.9177013 +1     4     2     9
  H     1.09941788 +1  112.1209420 +1  119.9119182 +1     4     2    10
  H     1.09755734 +1  111.2554050 +1  179.9570394 +1     5     2     1
  H     1.09940555 +1  112.1269253 +1  120.0496722 +1     5     2    12
  H     1.09959853 +1  112.1026591 +1  120.0319283 +1     5     2    13