Accuracy
dipropyl sulfite
2173 Dipropyl sulfite
(Previous)
(Back)
(Next)
Geometry predicted using PM7
ΔHf: -140.5 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
Dipropyl sulfite
H=-140.5 HR=NIST
O -0.02078921 +1 -0.01099388 +1 0.08686301 +1
S 1.48619665 +1 0.66917667 +1 0.19596156 +1
O 1.08436720 +1 2.23837500 +1 0.56712726 +1
C -0.88214926 +1 0.08557119 +1 -1.02307368 +1
C 0.88136974 +1 3.26701745 +1 -0.37104676 +1
O 2.01655939 +1 0.70232314 +1 -1.16836738 +1
C -2.02400516 +1 1.03972155 +1 -0.65657501 +1
C 2.22023655 +1 3.77188385 +1 -0.91768576 +1
C -3.00474780 +1 1.16347625 +1 -1.81780492 +1
C 2.02320493 +1 5.10472210 +1 -1.63479849 +1
H -1.24396764 +1 -0.95321295 +1 -1.16174290 +1
H -0.34117963 +1 0.40022112 +1 -1.93385678 +1
H 0.36553643 +1 4.03825798 +1 0.23765745 +1
H 0.21016220 +1 2.92541076 +1 -1.17856873 +1
H -1.62216252 +1 2.03117198 +1 -0.37447734 +1
H -2.53625632 +1 0.66931697 +1 0.25308652 +1
H 2.65771103 +1 3.02237451 +1 -1.61007960 +1
H 2.94831739 +1 3.87829455 +1 -0.09133646 +1
H -3.82139128 +1 1.85228858 +1 -1.57106837 +1
H -3.46121258 +1 0.19816308 +1 -2.06747917 +1
H -2.51792672 +1 1.54466656 +1 -2.72289857 +1
H 2.96574022 +1 5.46173878 +1 -2.06721369 +1
H 1.66329187 +1 5.88238338 +1 -0.95198647 +1
H 1.30194035 +1 5.01816889 +1 -2.45584065 +1