Accuracy

dimethyl sulfoxide   1526 Dimethyl sulfoxide

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

    

    #  Species Formula
  1516 N,N-(Dimethyl)thiobenzamideC9H11NS
  1517 PhenothiazineC12H9NS
  1518 ThioureaCH4N2S
  1519 TetramethylthioureaC5H12N2S
  1520 4,6-Bis(isopropylamino)-2-methylmercapto)-s-triazineC10H19N5S
  1521 Sulfur monoxide (triplet)OS
  1522 HOSHOS
  1523 Carbon oxysulfideCOS
  1524 Ethyne sulfenic acidC2H2OS
  1525 Thiolacetic acidC2H4OS
  1526 Dimethyl sulfoxide C2H6OS
  1527 Dimethyl sulfoxide (Geo)C2H6OS
  1528 S-EthylthioacetateC4H8OS
  1529 Diethyl sulfoxideC4H10OS
  1530 Benzenesulfenic acidC6H6OS
  1531 Dipropyl sulfoxideC6H14OS
  1532 PhenoxathiinC12H8OS
  1533 Diphenyl sulfoxideC12H10OS
  1534 ThioxanthoneC13H8OS
  1535 Bis-diethylamine sulfoxideC8H20N2OS
  1536 Sulfur dioxide (Geo)O2S


ΔHf: -36.1 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
Dipole: 4.0 Debye,     REF: A. L. McClellan, "Tables of Experimental Dipole Moments," Vol 2, Rahara Enterprises, El Cerrito, (1974).
I.P.: 9.0 eV,     REF: R. D. Levin, S. G. Lias, "Ionization Potentials and Appearance Potential Measurements," 1971-1981, Natl. Stand. Ref. Data Ser., Natl. Bur. Stand. 71, (1982), Cat. No. C13.48:71.
  
 SYMMETRY
Dimethyl sulfoxide
 H=-36.09 HR=C&P1970 I=9.01 IR=LLNBS82 D=3.96 DR=MCC1974
 
  S     0.00180881 +1  -0.02918757 +1   0.02721356 +1
  C    -1.37863346 +1   1.16770147 +1   0.00358074 +1
  C     1.38123120 +1   1.16895283 +1   0.00404333 +1
  O     0.00182800 +1  -0.62813319 +1   1.38227227 +1
  H    -2.32954490 +1   0.62511347 +1  -0.01602516 +1
  H     2.33252851 +1   0.62698354 +1  -0.01548393 +1
  H    -1.40063886 +1   1.80172704 +1   0.89441250 +1
  H    -1.33281729 +1   1.80960899 +1  -0.87631595 +1
  H     1.33504315 +1   1.81096305 +1  -0.87561039 +1
  H     1.40259595 +1   1.80277850 +1   0.89503958 +1