Accuracy

triphenylarsine   3978 Triphenylarsine

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    #  Species Formula
  3968 Arsenic, cationAs
  3969 Arsenic, atomAs
  3970 Arsine radical (Geo)H2As
  3971 ArsineH3As
  3972 Arsine (Geo)H3As
  3973 Trimethylarsine (Geo)C3H9As
  3974 TrimethylarsineC3H9As
  3975 As(V)C4(+) (MASINC10) (Geo)C4H12As
  3976 As(V)C4(+) (MASINC10)C4H12As
  3977 Triethylarsine (DFT)C6H15As
  3978 Triphenylarsine C18H15As
  3979 Arsenic nitrideNAs
  3980 AsH2-NH2H4NAs
  3981 AsH2-NH2 (Geo)H4NAs
  3982 As(III)C3 (CNMARS) (Geo)C3H6NAs
  3983 As(III)C3 (CNMARS)C3H6NAs
  3984 Arsenic tricyanide (Geo)C3N3As
  3985 As(V)C3O (ASOXCA) (Geo)C3H9OAs
  3986 As(V)C3O (ASOXCA)C3H9OAs
  3987 As(OH)3H3O3As
  3988 As(OH)3 (Geo)H3O3As


ΔHf: 97.6 kcal/mol,     REF: G. M. Kolyakova, I. B. Rabinovich, E. N Zoria, Dokl. Akad. Nauk SSSR, 209, 616 (1973).
  
 PM7
Triphenylarsine
 H=97.6 HR=KRZ1973 =1.3 DR=PW91D
 As     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.97816735 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.39974849 +1  123.4860606 +1    0.0000000 +0     2     1     0
  C     1.39428807 +1  120.8367431 +1 -178.3085249 +1     3     2     1
  C     1.39222172 +1  120.1848153 +1   -0.4336781 +1     4     3     2
  C     1.39283461 +1  119.5682452 +1    0.1357667 +1     5     4     3
  C     1.39373847 +1  120.2699425 +1    0.2395795 +1     6     5     4
  H     1.09352366 +1  121.0226306 +1    1.8046167 +1     3     2     1
  H     1.08797986 +1  119.7737550 +1  179.7418468 +1     4     3     2
  H     1.08766439 +1  120.2410018 +1 -179.8161017 +1     5     4     3
  H     1.08771085 +1  119.9347748 +1 -179.8630216 +1     6     5     4
  H     1.09349028 +1  117.9033095 +1  179.6753525 +1     7     6     5
  C     1.97730072 +1  100.3255001 +1  -90.6372800 +1     1     2     3
  C     1.39962523 +1  123.4102221 +1    2.4429371 +1    13     1     2
  C     1.39444148 +1  120.8329788 +1 -177.4897854 +1    14    13     1
  C     1.39202642 +1  120.2141857 +1   -0.5414586 +1    15    14    13
  C     1.39296164 +1  119.5448013 +1    0.0975756 +1    16    15    14
  C     1.39349595 +1  120.2707217 +1    0.3445852 +1    17    16    15
  H     1.09344784 +1  121.0733012 +1    2.7207178 +1    14    13     1
  H     1.08802305 +1  119.7483024 +1  179.6613306 +1    15    14    13
  H     1.08758353 +1  120.2579502 +1 -179.8158860 +1    16    15    14
  H     1.08777248 +1  119.9299459 +1 -179.7743418 +1    17    16    15
  H     1.09338060 +1  117.8932485 +1  179.6160201 +1    18    17    16
  C     1.97785395 +1   99.9977444 +1   11.9268339 +1     1     2     3
  C     1.39962763 +1  123.4101725 +1 -103.0239393 +1    24     1     2
  C     1.39435055 +1  120.8361022 +1 -177.4359643 +1    25    24     1
  C     1.39208019 +1  120.2158090 +1   -0.5503888 +1    26    25    24
  C     1.39294278 +1  119.5395718 +1    0.1000522 +1    27    26    25
  C     1.39352271 +1  120.2742304 +1    0.3409058 +1    28    27    26
  H     1.09341309 +1  121.0884585 +1    2.8215712 +1    25    24     1
  H     1.08798126 +1  119.7521643 +1  179.6595600 +1    26    25    24
  H     1.08753890 +1  120.2591871 +1 -179.7951270 +1    27    26    25
  H     1.08781678 +1  119.9345559 +1 -179.7338532 +1    28    27    26
  H     1.09334610 +1  117.8966830 +1  179.7016465 +1    29    28    27