Accuracy

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1313 Nitrogen trifluoride

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###  |  |
# | Species | Formula
1303 | Trifluoromethane (Geo) | HCF3 |
1304 | Trifluoromethane | HCF3 |
1305 | Trifluoroethylene | HC2F3 |
1306 | CF3CH2, cation | C2H2F3 |
1307 | CH2F.CF2, cation | C2H2F3 |
1308 | CF3CH2. | C2H2F3 |
1309 | 1,1,1-Trifluoroethane | C2H3F3 |
1310 | (Trifluoromethyl)-benzene | C7H5F3 |
1311 | Trifluoromethylbenzene | C7H5F3 |
1312 | Nitrogen trifluoride (Geo) | NF3 |
1313 | Nitrogen trifluoride | NF3 |
1314 | Trifluoroacetonitrile (Geo) | C2NF3 |
1315 | Trifluoroacetonitrile | C2NF3 |
1316 | Trifluoromethylisocyanide | C2NF3 |
1317 | F3NO | NOF3 |
1318 | Trifluoroacetic acid | HC2O2F3 |
1319 | Carbon tetrafluoride | CF4 |
1320 | Carbon tetrafluoride (Geo) | CF4 |
1321 | Tetrafluoroethylene (Geo) | C2F4 |
1322 | Tetrafluoroethylene | C2F4 |
1323 | 1,2,4,5-Tetrafluorobenzene | C6H2F4 |

ΔHf: -31.6 kcal/mol
Dipole: 0.2 Debye, REF:
I.P.: 13.7 eV, REF:

     SYMMETRY
    Nitrogen trifluoride
     I=13.73 IR=LLNBS82 D=.24 HR=JANAF86 H=-31.6 DR=MCC1963 S=62.33 CP=12.76

      N     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
     XX     1.37418613 +1    0.0000000 +0    0.0000000 +0     1     0     0
     XX     1.00000000 +0  120.0000000 +0    0.0000000 +0     2     1     0
      F     1.37418613 +0  118.4086217 +1  180.0000000 +1     1     2     3
      F     1.37418613 +0  118.4086217 +0   60.0000000 +0     1     2     3
      F     1.37418613 +0  118.4086217 +0  -60.0000000 +0     1     2     3

       2  1    4    5    6
       4  2    5    6