PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

nitrosyl chloride   2384 Nitrosyl chloride

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    #  Species Formula
  2374 LiCl.H2OH2LiOCl
  2375 LiCl.H2O (Geo)H2LiOCl
  2376 BOClBOCl
  2377 Carbonyl chloride (COCl)COCl
  2378 Acetyl chlorideC2H3OCl
  2379 Acetyl chloride (Geo)C2H3OCl
  2380 3-ChlorophenolC6H5OCl
  2381 4-ChlorophenolC6H5OCl
  2382 2-ChlorobenzaldehydeC7H5OCl
  2383 Benzoyl chlorideC7H5OCl
  2384 Nitrosyl chloride NOCl
  2385 NOCl (Geo)NOCl
  2386 Chlorine dioxideO2Cl
  2387 Chloroacetic acidC2H3O2Cl
  2388 DimethoxychloroboraneH6BC2O2Cl
  2389 2-Chlorobenzoic acidC7H5O2Cl
  2390 3-Chlorobenzoic acidC7H5O2Cl
  2391 4-Chlorobenzoic acidC7H5O2Cl
  2392 Nitryl chlorideNO2Cl
  2393 NO2Cl (Geo)NO2Cl
  2394 O3ClO3Cl


ΔHf: 12.4 kcal/mol,     REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
Dipole: 1.9 Debye,     REF: P. Winget, A.H.C. Horn, C. Seloki, B. Martin, T. Clark, J. Mol. Model. 9, 408 (2003).
I.P.: 10.9 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.
  
 PM7
Nitrosyl chloride
 H=12.36 HR=JANAF86 I=10.9 IR=LLNBS82 D=1.86 DR=WHSMC03
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     1.78998070 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.15255980 +1  114.8562310 +1    0.0000000 +0     2     1     0