Accuracy

trans-1,2-dichloroethane   2491 trans-1,2-Dichloroethane

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    #  Species Formula
  2481 DichloromethaneCH2Cl2
  2482 MethyldichloroboraneH3BCCl2
  2483 DichloroacetyleneC2Cl2
  2484 1,1-DichloroethyleneC2H2Cl2
  2485 cis-DichloroethyleneC2H2Cl2
  2486 cis-Dichloroethylene (Geo)C2H2Cl2
  2487 trans-1,2-DichloroethyleneC2H2Cl2
  2488 trans-DichloroethyleneC2H2Cl2
  2489 1,1-DichloroethaneC2H4Cl2
  2490 1,1-Dichloroethane (Geo)C2H4Cl2
  2491 trans-1,2-Dichloroethane C2H4Cl2
  2492 trans-1,2-Dichloroethane (Geo)C2H4Cl2
  2493 1,2-DichloropropaneC3H6Cl2
  2494 1,2-DichlorobenzeneC6H4Cl2
  2495 1,3-DichlorobenzeneC6H4Cl2
  2496 1,4-DichlorobenzeneC6H4Cl2
  2497 Be(II)Cl2N2 (MECYBC) (Geo)H6BeC4N2Cl2
  2498 Be(II)Cl2N2 (MECYBC)H6BeC4N2Cl2
  2499 Be(II)Cl2N2 (VALHAS) (Geo)H22BeC8N2Cl2
  2500 Be(II)Cl2N2 (VALHAS)H22BeC8N2Cl2
  2501 Chlorine monoxideOCl2


ΔHf: -30.3 kcal/mol,     REF: P. Winget, A.H.C. Horn, C. Seloki, B. Martin, T. Clark, J. Mol. Model. 9, 408 (2003).
  
 PM7
trans-1,2-Dichloroethane
 H=-30.3 HR=WHSMC03
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.50800019 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     1.77884526 +1  107.5812523 +1    0.0000000 +0     2     1     0
 Cl     1.77884533 +1  107.5730776 +1 -179.9122263 +1     1     2     3
  H     1.10561520 +1  113.4638782 +1  117.7332906 +1     1     2     4
  H     1.10565446 +1  113.3493120 +1  124.4791055 +1     1     2     5
  H     1.10562678 +1  113.4563429 +1  117.7359357 +1     2     1     3
  H     1.10565279 +1  113.3473098 +1  124.4695387 +1     2     1     7