Accuracy

1,1-dichloroethane   2489 1,1-Dichloroethane

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    #  Species Formula
  2479 CHCl2(+)HCCl2
  2480 Dichloromethane (Geo)CH2Cl2
  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-Dichloroethane C2H4Cl2
  2490 1,1-Dichloroethane (Geo)C2H4Cl2
  2491 trans-1,2-DichloroethaneC2H4Cl2
  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


ΔHf: -30.5 kcal/mol,     REF: P. Winget, A.H.C. Horn, C. Seloki, B. Martin, T. Clark, J. Mol. Model. 9, 408 (2003).
  
 PM7
1,1-Dichloroethane
 H=-30.5 HR=WHSMC03
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.49856485 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     1.77654251 +1  109.6128352 +1    0.0000000 +0     1     2     0
 Cl     1.77593589 +1  109.6935792 +1  118.1244984 +1     1     2     3
  H     1.10781017 +1  115.4140213 +1  120.8109085 +1     1     2     4
  H     1.10272358 +1  111.9949181 +1 -177.8347716 +1     2     1     3
  H     1.10375459 +1  112.9155659 +1  119.9657193 +1     2     1     6
  H     1.10252862 +1  111.9719472 +1  120.1462897 +1     2     1     7