Accuracy

chloroacetic acid   2386 Chloroacetic acid

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    #  Species Formula
  2376 Carbonyl chloride (COCl)COCl
  2377 Acetyl chlorideC2H3OCl
  2378 Acetyl chloride (Geo)C2H3OCl
  2379 3-ChlorophenolC6H5OCl
  2380 4-ChlorophenolC6H5OCl
  2381 2-ChlorobenzaldehydeC7H5OCl
  2382 Benzoyl chlorideC7H5OCl
  2383 Nitrosyl chlorideNOCl
  2384 NOCl (Geo)NOCl
  2385 Chlorine dioxideO2Cl
  2386 Chloroacetic acid C2H3O2Cl
  2387 DimethoxychloroboraneH6BC2O2Cl
  2388 2-Chlorobenzoic acidC7H5O2Cl
  2389 3-Chlorobenzoic acidC7H5O2Cl
  2390 4-Chlorobenzoic acidC7H5O2Cl
  2391 Nitryl chlorideNO2Cl
  2392 NO2Cl (Geo)NO2Cl
  2393 O3ClO3Cl
  2394 B3O3H2ClH2B3O3Cl
  2395 O4Cl(-)O4Cl
  2396 HOClO3 (Geo)HO4Cl


ΔHf: -104.0 kcal/mol,     REF: P. Winget, A.H.C. Horn, C. Seloki, B. Martin, T. Clark, J. Mol. Model. 9, 408 (2003).
  
 PM7
Chloroacetic acid
 H=-104 HR=WHSMC03
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.49579670 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     1.75787867 +1  109.5507795 +1    0.0000000 +0     1     2     0
  O     1.19798223 +1  130.4609112 +1   -0.0486280 +1     2     1     3
  O     1.36101214 +1  108.2126976 +1  179.9967116 +1     2     1     4
  H     1.10896731 +1  111.5645589 +1  119.7150861 +1     1     2     3
  H     1.10918252 +1  111.4775504 +1  120.5509925 +1     1     2     6
  H     0.99010080 +1  113.7201621 +1  179.9982499 +1     5     2     1