Accuracy

triphenylphosphine   1386 Triphenylphosphine

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    #  Species Formula
  1376 Methylphosphine (Geo)CH5P
  1377 MethylphosphineCH5P
  1378 PhosphetetheneC2H5P
  1379 DimethylphosphineC2H7P
  1380 EthylphosphineC2H7P
  1381 Trimethylphosphine (Geo)C3H9P
  1382 TrimethylphosphineC3H9P
  1383 Protonated trimethylphosphineC3H10P
  1384 DiethylphosphineC4H11P
  1385 Phosphole (Geo)C5H5P
  1386 Triphenylphosphine C18H15P
  1387 Phosphorus nitrideNP
  1388 HPNHNP
  1389 PNHHNP
  1390 PNH2 (singlet)H2NP
  1391 trans-HPNHH2NP
  1392 (CH3)2P=NEtC5H14NP
  1393 Trimethylphosphine-N-ethylimineC5H14NP
  1394 Hexamethylphosphorous triamideC6H18N3P
  1395 Tris(diethylamino)phosphineC12H30N3P
  1396 Phosphorus oxideOP


ΔHf: 78.5 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
  
 GEO-OK
Triphenylphosphine
 H=78.5 HR=C&P1970
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.39165795 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.39432303 +1  120.4408679 +1    0.0000000 +0     2     1     0
  C     1.40338090 +1  119.8227526 +1   -0.1587016 +1     3     2     1
  C     1.40696107 +1  119.6733349 +1   -0.3873575 +1     4     3     2
  C     1.39275168 +1  119.8543753 +1    0.1903420 +1     1     2     3
  P     1.86265969 +1  122.5159984 +1 -178.2980362 +1     4     3     2
  C     1.86289968 +1  105.9978241 +1    6.1438030 +1     7     4     3
  C     1.40661943 +1  117.7612451 +1   81.0511629 +1     8     7     4
  C     1.39368619 +1  119.6761727 +1  179.2019485 +1     9     8     7
  C     1.39247566 +1  120.5190584 +1   -0.7420982 +1    10     9     8
  C     1.39200168 +1  119.8594850 +1    0.1327739 +1    11    10     9
  C     1.40383231 +1  122.5368832 +1 -100.6317179 +1     8     7     4
  C     1.86284668 +1  106.0526562 +1 -106.1354683 +1     7     4     3
  C     1.40340904 +1  122.5854164 +1    6.9490350 +1    14     7     4
  C     1.39423466 +1  119.8206547 +1 -178.5199669 +1    15    14     7
  C     1.39186374 +1  120.4490217 +1   -0.2981090 +1    16    15    14
  C     1.39272877 +1  119.8553323 +1    0.3819737 +1    17    16    15
  C     1.40681904 +1  117.7315628 +1 -171.2219243 +1    14     7     4
  H     1.08928150 +1  120.0929740 +1 -179.9622292 +1     1     2     3
  H     1.08930208 +1  120.0166043 +1 -179.9041890 +1     2     1     6
  H     1.09565418 +1  117.6122403 +1  179.6474221 +1     3     2     1
  H     1.09790764 +1  122.7084443 +1 -178.9049357 +1     5     4     3
  H     1.08949672 +1  119.9366827 +1  179.8943672 +1     6     1     2
  H     1.09805777 +1  122.7174145 +1   -0.6272954 +1     9     8     7
  H     1.08946788 +1  119.5233299 +1  179.6692889 +1    10     9     8
  H     1.08937228 +1  120.0600270 +1 -179.7079157 +1    11    10     9
  H     1.08930349 +1  120.0190158 +1 -179.7445513 +1    12    11    10
  H     1.09570301 +1  122.5296014 +1    1.5893131 +1    13     8     7
  H     1.09564071 +1  122.5529799 +1    1.7292828 +1    15    14     7
  H     1.08927133 +1  119.5285175 +1  179.8510611 +1    16    15    14
  H     1.08931965 +1  120.0929204 +1 -179.7944231 +1    17    16    15
  H     1.08953940 +1  119.9356901 +1  179.8232670 +1    18    17    16
  H     1.09796483 +1  122.7124503 +1   -0.6320716 +1    19    14     7