PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
dimethyl sulfite
2170 Dimethyl sulfite
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ΔHf: -115.5 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
Dimethyl sulfite
H=-115.5 HR=NIST
O -0.00748654 +1 -0.06799599 +1 0.09760469 +1
S 1.64467667 +1 -0.04098834 +1 -0.08830096 +1
O 1.91509012 +1 1.60051150 +1 -0.05261722 +1
C -0.91012327 +1 0.09837475 +1 -0.96544243 +1
C 1.81259958 +1 2.41623700 +1 -1.19163705 +1
O 1.90339989 +1 -0.45558905 +1 -1.46802573 +1
H -1.83158174 +1 -0.38510985 +1 -0.60799256 +1
H -0.56050845 +1 -0.38919412 +1 -1.88505760 +1
H -1.08171873 +1 1.16942949 +1 -1.12655531 +1
H 2.33241350 +1 3.33964779 +1 -0.89744924 +1
H 0.75715322 +1 2.62328617 +1 -1.40354242 +1
H 2.30996305 +1 1.96390352 +1 -2.06040583 +1