Accuracy

tripropylborane    275 Tripropylborane

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    #  Species Formula
   265 n-OctaneC8H18
   266 Li(I)4(Et)4 (ETHYLI) (Geo)C8H20Li4
   267 Li(I)4(Et)4 (ETHYLI)C8H20Li4
   268 alpha-Methyl styreneC9H10
   269 Cyclopropyl benzeneC9H10
   270 1,3,5-Trimethyl cyclohexaneC9H18
   271 cis-cis-trans-1,3,5-Trimethyl cyclohexaneC9H18
   272 3,3-DiethylpentaneC9H20
   273 n-NonaneC9H20
   274 Tri-isopropylboraneH21BC9
   275 Tripropylborane H21BC9
   276 AzuleneC10H8
   277 Naphthalene (Geo)C10H8
   278 NaphthaleneC10H8
   279 1,4-Dicyclopropylbuta-1,3-diyneC10H10
   280 1-Butynl benzeneC10H10
   281 2a,4a,6a,6b-TetrahydrocyclopentapentaleneC10H10
   282 BulvaleneC10H10
   283 DiisopropenyldiacetyleneC10H10
   284 Tricyclo[6.2.0.0]deca-1(8),2,6-trieneC10H10
   285 1,2,6,7-CyclodecatetraeneC10H12


ΔHf: -56.6 kcal/mol,     REF: G. M. Kolyakova, I. B. Rabinovich, E. N Zoria, Dokl. Akad. Nauk SSSR, 209, 616 (1973).
  
 PM7
Tripropylborane
 H=-56.6 HR=KRZ1973
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52567245 +1    0.0000000 +0    0.0000000 +0     1     0     0
  B     1.59525247 +1  115.5177447 +1    0.0000000 +0     2     1     0
  C     1.60159319 +1  117.0054339 +1 -158.6576871 +1     3     2     1
  C     1.53112778 +1  107.6811598 +1   96.2817110 +1     4     3     2
  C     1.53215822 +1  110.4217894 +1  179.3732538 +1     5     4     3
  H     1.10824139 +1  110.8046782 +1   58.0444289 +1     5     4     3
  H     1.10784528 +1  110.7104198 +1  -59.3197148 +1     5     4     3
  H     1.10262897 +1  110.8105816 +1  -24.7706021 +1     4     3     2
  H     1.10295050 +1  110.6924712 +1 -142.4747189 +1     4     3     2
  C     1.59020478 +1  120.9002521 +1   23.1926750 +1     3     2     1
  H     1.10973801 +1  105.4733939 +1   78.9624352 +1     2     3     4
  H     1.10634971 +1  108.9753676 +1  -34.0088647 +1     2     3     4
  C     1.53094944 +1  111.8933855 +1   74.6478955 +1     1     2     3
  H     1.10690759 +1  111.0712255 +1  -48.6594314 +1     1     2     3
  H     1.10933566 +1  109.3967773 +1 -164.2524013 +1     1     2     3
  C     1.52517733 +1  115.4308563 +1  171.8579792 +1    11     3     2
  H     1.10785409 +1  107.9237454 +1   47.8643640 +1    11     3     2
  H     1.10931958 +1  106.8038294 +1  -64.9902069 +1    11     3     2
  C     1.53244428 +1  110.6917197 +1  177.9328425 +1    17    11     3
  H     1.10753670 +1  110.6603554 +1   56.3980740 +1    17    11     3
  H     1.10714760 +1  110.5345063 +1  -60.5424606 +1    17    11     3
  H     1.09502687 +1  111.2286287 +1 -179.9581515 +1     6     5     4
  H     1.09538435 +1  111.3218663 +1   60.0113209 +1     6     5     4
  H     1.09549955 +1  111.3249932 +1  -59.9335579 +1     6     5     4
  H     1.09528327 +1  111.1686592 +1  178.7175533 +1    14     1     2
  H     1.09547850 +1  111.3273359 +1   58.7892340 +1    14     1     2
  H     1.09510865 +1  111.7846929 +1  -61.2634410 +1    14     1     2
  H     1.09490959 +1  111.2002225 +1  179.5986280 +1    20    17    11
  H     1.09512367 +1  111.3408849 +1   59.6237498 +1    20    17    11
  H     1.09512427 +1  111.3435538 +1  -60.4188055 +1    20    17    11