PhN2+ CF3COO-

n d, A Eh E, kJ/mol
43 min 1.3211 -867.3687 5.627
68 max 1.5717 -867.3411 77.860
69 min 1.5817 -867.3708 0.000
103 max 1.9226 -867.3425 74.431
104 min 1.9326 -867.3467 63.155
122 max 2.1130 -867.3419 75.898
252 min 3.4163 -867.3607 26.466

n d, A Eh E, kJ/mol
1 0.9000 -866.9326 1150.397
2 0.9100 -866.9647 1066.179
3 0.9201 -866.9948 987.134
4 0.9301 -867.0231 912.954
5 0.9401 -867.0496 843.370
6 0.9501 -867.0744 778.174
7 0.9602 -867.0977 717.069
8 0.9702 -867.1195 659.891
9 0.9802 -867.1398 606.416
10 0.9902 -867.1589 556.375
11 1.0003 -867.1767 509.654
12 1.0103 -867.1933 466.058
13 1.0203 -867.2088 425.390
14 1.0303 -867.2232 387.514
15 1.0404 -867.2366 352.244
16 1.0504 -867.2491 319.479
17 1.0604 -867.2607 289.049
18 1.0704 -867.2714 260.882
19 1.0805 -867.2814 234.690
20 1.0905 -867.2906 210.550
21 1.1005 -867.2991 188.273
22 1.1105 -867.3069 167.734
23 1.1206 -867.3141 148.891
24 1.1306 -867.3207 131.566
25 1.1406 -867.3267 115.755
26 1.1506 -867.3322 101.338
27 1.1607 -867.3372 88.231
28 1.1707 -867.3417 76.397
29 1.1807 -867.3458 65.634
30 1.1907 -867.3495 56.035
31 1.2008 -867.3527 47.468
32 1.2108 -867.3556 39.872
33 1.2208 -867.3582 33.188
34 1.2308 -867.3604 27.363
35 1.2409 -867.3623 22.352
36 1.2509 -867.3639 18.042
37 1.2609 -867.3653 14.487
38 1.2709 -867.3664 11.597
39 1.2810 -867.3672 9.328
40 1.2910 -867.3679 7.609
41 1.3010 -867.3683 6.455
42 1.3110 -867.3686 5.807
43 1.3211 -867.3687 5.627
44 1.3311 -867.3686 5.883
45 1.3411 -867.3683 6.507
46 1.3511 -867.3679 7.534
47 1.3612 -867.3674 8.907
48 1.3712 -867.3668 10.595
49 1.3812 -867.3660 12.573
50 1.3912 -867.3652 14.783
51 1.4013 -867.3642 17.248
52 1.4113 -867.3632 19.952
53 1.4213 -867.3621 22.855
54 1.4313 -867.3609 25.906
55 1.4414 -867.3597 29.140
56 1.4514 -867.3584 32.489
57 1.4614 -867.3571 35.985
58 1.4714 -867.3557 39.587
59 1.4815 -867.3543 43.229
60 1.4915 -867.3529 46.982
61 1.5015 -867.3515 50.744
62 1.5115 -867.3500 54.596
63 1.5216 -867.3485 58.460
64 1.5316 -867.3471 62.305
65 1.5416 -867.3456 66.197
66 1.5516 -867.3441 70.101
67 1.5617 -867.3426 73.991
68 1.5717 -867.3411 77.860
69 1.5817 -867.3708 0.000
70 1.5917 -867.3700 2.081
71 1.6018 -867.3692 4.219
72 1.6118 -867.3684 6.404
73 1.6218 -867.3675 8.628
74 1.6318 -867.3667 10.885
75 1.6419 -867.3658 13.170
76 1.6519 -867.3649 15.478
77 1.6619 -867.3640 17.803
78 1.6719 -867.3631 20.143
79 1.6820 -867.3622 22.492
80 1.6920 -867.3613 24.847
81 1.7020 -867.3604 27.204
82 1.7120 -867.3595 29.561
83 1.7221 -867.3586 31.914
84 1.7321 -867.3578 34.260
85 1.7421 -867.3569 36.597
86 1.7521 -867.3560 38.922
87 1.7622 -867.3551 41.233
88 1.7722 -867.3542 43.528
89 1.7822 -867.3534 45.804
90 1.7922 -867.3525 48.015
91 1.8023 -867.3517 50.246
92 1.8123 -867.3508 52.459
93 1.8223 -867.3500 54.647
94 1.8323 -867.3492 56.768
95 1.8424 -867.3484 58.891
96 1.8524 -867.3476 60.991
97 1.8624 -867.3468 62.994
98 1.8724 -867.3460 65.009
99 1.8825 -867.3453 67.003
100 1.8925 -867.3446 68.878
101 1.9025 -867.3439 70.752
102 1.9125 -867.3431 72.610
103 1.9226 -867.3425 74.431
104 1.9326 -867.3467 63.155
105 1.9426 -867.3463 64.274
106 1.9526 -867.3459 65.346
107 1.9627 -867.3455 66.378
108 1.9727 -867.3451 67.374
109 1.9827 -867.3448 68.304
110 1.9927 -867.3444 69.211
111 2.0028 -867.3441 70.001
112 2.0128 -867.3438 70.799
113 2.0228 -867.3435 71.566
114 2.0328 -867.3433 72.188
115 2.0429 -867.3431 72.832
116 2.0529 -867.3428 73.449
117 2.0629 -867.3426 73.933
118 2.0729 -867.3425 74.429
119 2.0830 -867.3423 74.904
120 2.0930 -867.3421 75.227
121 2.1030 -867.3420 75.571
122 2.1130 -867.3419 75.898
123 2.1231 -867.3476 60.964
124 2.1331 -867.3479 60.187
125 2.1431 -867.3482 59.409
126 2.1531 -867.3485 58.651
127 2.1632 -867.3487 57.901
128 2.1732 -867.3490 57.162
129 2.1832 -867.3493 56.414
130 2.1932 -867.3496 55.691
131 2.2033 -867.3499 54.980
132 2.2133 -867.3501 54.283
133 2.2233 -867.3504 53.563
134 2.2333 -867.3507 52.880
135 2.2434 -867.3509 52.211
136 2.2534 -867.3512 51.518
137 2.2634 -867.3514 50.867
138 2.2734 -867.3517 50.233
139 2.2835 -867.3519 49.571
140 2.2935 -867.3522 48.953
141 2.3035 -867.3524 48.353
142 2.3135 -867.3526 47.723
143 2.3236 -867.3528 47.140
144 2.3336 -867.3531 46.576
145 2.3436 -867.3533 45.980
146 2.3536 -867.3535 45.432
147 2.3637 -867.3537 44.903
148 2.3737 -867.3539 44.342
149 2.3837 -867.3541 43.829
150 2.3937 -867.3543 43.337
151 2.4038 -867.3545 42.826
152 2.4138 -867.3547 42.341
153 2.4238 -867.3549 41.868
154 2.4338 -867.3550 41.405
155 2.4439 -867.3552 40.953
156 2.4539 -867.3554 40.511
157 2.4639 -867.3555 40.080
158 2.4739 -867.3557 39.660
159 2.4840 -867.3559 39.249
160 2.4940 -867.3560 38.849
161 2.5040 -867.3562 38.458
162 2.5140 -867.3563 38.078
163 2.5241 -867.3564 37.707
164 2.5341 -867.3566 37.346
165 2.5441 -867.3567 36.994
166 2.5541 -867.3568 36.652
167 2.5642 -867.3570 36.318
168 2.5742 -867.3577 34.403
169 2.5842 -867.3578 34.110
170 2.5942 -867.3579 33.829
171 2.6043 -867.3580 33.558
172 2.6143 -867.3581 33.295
173 2.6243 -867.3582 33.040
174 2.6343 -867.3583 32.792
175 2.6444 -867.3584 32.552
176 2.6544 -867.3585 32.319
177 2.6644 -867.3586 32.093
178 2.6744 -867.3587 31.874
179 2.6845 -867.3587 31.661
180 2.6945 -867.3588 31.455
181 2.7045 -867.3589 31.255
182 2.7145 -867.3590 31.062
183 2.7246 -867.3590 30.874
184 2.7346 -867.3591 30.692
185 2.7446 -867.3592 30.515
186 2.7546 -867.3593 30.289
187 2.7647 -867.3593 30.121
188 2.7747 -867.3594 29.965
189 2.7847 -867.3594 29.819
190 2.7947 -867.3595 29.677
191 2.8048 -867.3596 29.539
192 2.8148 -867.3596 29.406
193 2.8248 -867.3597 29.277
194 2.8348 -867.3597 29.153
195 2.8449 -867.3597 29.032
196 2.8549 -867.3598 28.916
197 2.8649 -867.3598 28.803
198 2.8749 -867.3599 28.695
199 2.8850 -867.3599 28.532
200 2.8950 -867.3600 28.438
201 2.9050 -867.3600 28.333
202 2.9150 -867.3600 28.232
203 2.9251 -867.3601 28.136
204 2.9351 -867.3601 28.045
205 2.9451 -867.3602 27.959
206 2.9551 -867.3602 27.876
207 2.9652 -867.3602 27.797
208 2.9752 -867.3602 27.721
209 2.9852 -867.3603 27.648
210 2.9952 -867.3603 27.578
211 3.0053 -867.3603 27.511
212 3.0153 -867.3603 27.447
213 3.0253 -867.3604 27.385
214 3.0353 -867.3604 27.326
215 3.0454 -867.3604 27.269
216 3.0554 -867.3604 27.215
217 3.0654 -867.3605 27.164
218 3.0754 -867.3605 27.114
219 3.0855 -867.3605 27.067
220 3.0955 -867.3605 27.022
221 3.1055 -867.3605 26.980
222 3.1155 -867.3605 26.939
223 3.1256 -867.3606 26.900
224 3.1356 -867.3606 26.864
225 3.1456 -867.3606 26.829
226 3.1556 -867.3606 26.796
227 3.1657 -867.3606 26.765
228 3.1757 -867.3606 26.736
229 3.1857 -867.3606 26.708
230 3.1957 -867.3606 26.682
231 3.2058 -867.3606 26.658
232 3.2158 -867.3607 26.636
233 3.2258 -867.3607 26.615
234 3.2358 -867.3607 26.595
235 3.2459 -867.3607 26.577
236 3.2559 -867.3607 26.560
237 3.2659 -867.3607 26.545
238 3.2759 -867.3607 26.530
239 3.2860 -867.3607 26.517
240 3.2960 -867.3607 26.506
241 3.3060 -867.3607 26.495
242 3.3160 -867.3607 26.491
243 3.3261 -867.3607 26.487
244 3.3361 -867.3607 26.482
245 3.3461 -867.3607 26.479
246 3.3561 -867.3607 26.475
247 3.3662 -867.3607 26.472
248 3.3762 -867.3607 26.470
249 3.3862 -867.3607 26.468
250 3.3962 -867.3607 26.467
251 3.4063 -867.3607 26.466
252 3.4163 -867.3607 26.466
253 3.4263 -867.3607 26.466
254 3.4363 -867.3607 26.467
255 3.4464 -867.3607 26.469
256 3.4564 -867.3607 26.471
257 3.4664 -867.3607 26.474
258 3.4764 -867.3607 26.478
259 3.4865 -867.3607 26.482
260 3.4965 -867.3607 26.487
261 3.5065 -867.3607 26.492
262 3.5165 -867.3607 26.498
263 3.5266 -867.3607 26.504
264 3.5366 -867.3607 26.510
265 3.5466 -867.3607 26.517
266 3.5566 -867.3607 26.525
267 3.5667 -867.3607 26.532
268 3.5767 -867.3607 26.540
269 3.5867 -867.3607 26.549
270 3.5967 -867.3607 26.557
271 3.6068 -867.3607 26.566
272 3.6168 -867.3607 26.575
273 3.6268 -867.3607 26.584
274 3.6368 -867.3607 26.594
275 3.6469 -867.3607 26.603
276 3.6569 -867.3607 26.613
277 3.6669 -867.3607 26.622
278 3.6769 -867.3607 26.632
279 3.6870 -867.3607 26.642
280 3.6970 -867.3607 26.652
281 3.7070 -867.3606 26.662
282 3.7170 -867.3606 26.672
283 3.7271 -867.3606 26.682
284 3.7371 -867.3606 26.693
285 3.7471 -867.3606 26.703
286 3.7571 -867.3606 26.713
287 3.7672 -867.3606 26.718
288 3.7772 -867.3606 26.725
289 3.7872 -867.3606 26.733
290 3.7972 -867.3606 26.741
291 3.8073 -867.3606 26.750
292 3.8173 -867.3606 26.760
293 3.8273 -867.3606 26.770
294 3.8373 -867.3606 26.780
295 3.8474 -867.3606 26.790
296 3.8574 -867.3606 26.800
297 3.8674 -867.3606 26.811
298 3.8774 -867.3606 26.822
299 3.8875 -867.3606 26.832
300 3.8975 -867.3606 26.843
301 3.9075 -867.3606 26.860
302 3.9175 -867.3606 26.878
303 3.9276 -867.3606 26.872
304 3.9376 -867.3606 26.888
305 3.9476 -867.3606 26.907
306 3.9576 -867.3606 26.903
307 3.9677 -867.3605 26.919
308 3.9777 -867.3605 26.938
309 3.9877 -867.3605 26.935
310 3.9977 -867.3605 26.951
311 4.0078 -867.3605 26.953
312 4.0178 -867.3605 26.969
313 4.0278 -867.3605 26.973
314 4.0378 -867.3605 26.989
315 4.0479 -867.3605 26.994
316 4.0579 -867.3605 27.010
317 4.0679 -867.3605 27.015
318 4.0779 -867.3605 27.031
319 4.0880 -867.3605 27.036
320 4.0980 -867.3605 27.052
321 4.1080 -867.3605 27.057
322 4.1180 -867.3605 27.073
323 4.1281 -867.3605 27.078
324 4.1381 -867.3605 27.094
325 4.1481 -867.3605 27.099
326 4.1581 -867.3605 27.115
327 4.1682 -867.3605 27.120
328 4.1782 -867.3605 27.136
329 4.1882 -867.3605 27.153
330 4.1982 -867.3605 27.153
331 4.2083 -867.3605 27.169
332 4.2183 -867.3604 27.187
333 4.2283 -867.3604 27.186
334 4.2383 -867.3604 27.202
335 4.2484 -867.3604 27.219
336 4.2584 -867.3604 27.219
337 4.2684 -867.3604 27.235
338 4.2784 -867.3604 27.252
339 4.2885 -867.3604 27.252
340 4.2985 -867.3604 27.267
341 4.3085 -867.3604 27.285
342 4.3185 -867.3604 27.285
343 4.3286 -867.3604 27.301
344 4.3386 -867.3604 27.318
345 4.3486 -867.3604 27.318
346 4.3586 -867.3604 27.333
347 4.3687 -867.3604 27.337
348 4.3787 -867.3604 27.352
349 4.3887 -867.3604 27.356
350 4.3987 -867.3604 27.372
351 4.4088 -867.3604 27.377
352 4.4188 -867.3604 27.392
353 4.4288 -867.3604 27.396
354 4.4388 -867.3604 27.411
355 4.4489 -867.3604 27.416
356 4.4589 -867.3604 27.431
357 4.4689 -867.3604 27.436
358 4.4789 -867.3603 27.451
359 4.4890 -867.3603 27.456
360 4.4990 -867.3603 27.470
361 4.5090 -867.3603 27.474
362 4.5190 -867.3603 27.489
363 4.5291 -867.3603 27.493
364 4.5391 -867.3603 27.507
365 4.5491 -867.3603 27.512
366 4.5591 -867.3603 27.527
367 4.5692 -867.3603 27.531
368 4.5792 -867.3603 27.545
369 4.5892 -867.3603 27.550
370 4.5992 -867.3603 27.564
371 4.6093 -867.3603 27.568
372 4.6193 -867.3603 27.582
373 4.6293 -867.3603 27.586
374 4.6393 -867.3603 27.600
375 4.6494 -867.3603 27.604
376 4.6594 -867.3603 27.618
377 4.6694 -867.3603 27.621
378 4.6794 -867.3603 27.636
379 4.6895 -867.3603 27.639
380 4.6995 -867.3603 27.653
381 4.7095 -867.3603 27.657
382 4.7195 -867.3603 27.671
383 4.7296 -867.3603 27.674
384 4.7396 -867.3603 27.688
385 4.7496 -867.3603 27.691
386 4.7596 -867.3602 27.705
387 4.7697 -867.3602 27.708
388 4.7797 -867.3602 27.722
389 4.7897 -867.3602 27.725
390 4.7997 -867.3602 27.739
391 4.8098 -867.3602 27.742
392 4.8198 -867.3602 27.756
393 4.8298 -867.3602 27.759
394 4.8398 -867.3602 27.773
395 4.8499 -867.3602 27.776
396 4.8599 -867.3602 27.789
397 4.8699 -867.3602 27.792
398 4.8799 -867.3602 27.805
399 4.8900 -867.3602 27.808
400 4.9000 -867.3602 27.821