4-MeOPhN2+

n d, A Eh E, kJ/mol
47 min 1.3612 -455.4347 0.000

n d, A Eh E, kJ/mol
1 0.9000 -454.9436 1289.405
2 0.9100 -454.9960 1151.672
3 0.9201 -455.0272 1069.867
4 0.9301 -455.0565 992.983
5 0.9401 -455.0840 920.746
6 0.9501 -455.1098 852.929
7 0.9602 -455.1341 789.263
8 0.9702 -455.1568 729.534
9 0.9802 -455.1782 673.540
10 0.9902 -455.1981 621.052
11 1.0003 -455.2169 571.907
12 1.0103 -455.2344 525.899
13 1.0203 -455.2508 482.874
14 1.0303 -455.2661 442.641
15 1.0404 -455.2804 405.081
16 1.0504 -455.2938 370.032
17 1.0604 -455.3062 337.353
18 1.0704 -455.3178 306.899
19 1.0805 -455.3286 278.581
20 1.0905 -455.3386 252.264
21 1.1005 -455.3479 227.835
22 1.1105 -455.3565 205.188
23 1.1206 -455.3645 184.224
24 1.1306 -455.3719 164.836
25 1.1406 -455.3787 146.966
26 1.1506 -455.3850 130.513
27 1.1607 -455.3907 115.394
28 1.1707 -455.3960 101.533
29 1.1807 -455.4009 88.858
30 1.1907 -455.4053 77.302
31 1.2008 -455.4093 66.799
32 1.2108 -455.4129 57.288
33 1.2208 -455.4161 48.710
34 1.2308 -455.4191 41.009
35 1.2409 -455.4217 34.133
36 1.2509 -455.4240 28.032
37 1.2609 -455.4261 22.658
38 1.2709 -455.4279 17.967
39 1.2810 -455.4294 13.915
40 1.2910 -455.4307 10.461
41 1.3010 -455.4318 7.566
42 1.3110 -455.4327 5.194
43 1.3211 -455.4334 3.309
44 1.3311 -455.4340 1.879
45 1.3411 -455.4344 0.870
46 1.3511 -455.4346 0.253
47 1.3612 -455.4347 0.000
48 1.3712 -455.4347 0.083
49 1.3812 -455.4345 0.476
50 1.3912 -455.4343 1.155
51 1.4013 -455.4339 2.097
52 1.4113 -455.4334 3.279
53 1.4213 -455.4329 4.680
54 1.4313 -455.4323 6.281
55 1.4414 -455.4316 8.063
56 1.4514 -455.4309 10.007
57 1.4614 -455.4301 12.098
58 1.4714 -455.4292 14.318
59 1.4815 -455.4284 16.652
60 1.4915 -455.4274 19.088
61 1.5015 -455.4265 21.610
62 1.5115 -455.4255 24.206
63 1.5216 -455.4245 26.865
64 1.5316 -455.4234 29.576
65 1.5416 -455.4224 32.328
66 1.5516 -455.4213 35.111
67 1.5617 -455.4203 37.917
68 1.5717 -455.4192 40.737
69 1.5817 -455.4181 43.564
70 1.5917 -455.4170 46.389
71 1.6018 -455.4160 49.207
72 1.6118 -455.4149 52.011
73 1.6218 -455.4138 54.796
74 1.6318 -455.4128 57.556
75 1.6419 -455.4117 60.287
76 1.6519 -455.4107 62.986
77 1.6619 -455.4097 65.648
78 1.6719 -455.4087 68.270
79 1.6820 -455.4077 70.849
80 1.6920 -455.4067 73.383
81 1.7020 -455.4058 75.870
82 1.7120 -455.4049 78.307
83 1.7221 -455.4040 80.694
84 1.7321 -455.4031 83.029
85 1.7421 -455.4022 85.312
86 1.7521 -455.4014 87.541
87 1.7622 -455.4005 89.716
88 1.7722 -455.3997 91.837
89 1.7822 -455.3989 93.905
90 1.7922 -455.3982 95.918
91 1.8023 -455.3974 97.877
92 1.8123 -455.3967 99.783
93 1.8223 -455.3960 101.636
94 1.8323 -455.3953 103.437
95 1.8424 -455.3946 105.187
96 1.8524 -455.3940 106.887
97 1.8624 -455.3934 108.536
98 1.8724 -455.3927 110.138
99 1.8825 -455.3922 111.691
100 1.8925 -455.3916 113.199
101 1.9025 -455.3910 114.661
102 1.9125 -455.3905 116.079
103 1.9226 -455.3900 117.453
104 1.9326 -455.3895 118.786
105 1.9426 -455.3890 120.078
106 1.9526 -455.3885 121.331
107 1.9627 -455.3880 122.545
108 1.9727 -455.3876 123.722
109 1.9827 -455.3871 124.862
110 1.9927 -455.3867 125.968
111 2.0028 -455.3863 127.040
112 2.0128 -455.3859 128.079
113 2.0228 -455.3855 129.086
114 2.0328 -455.3852 130.063
115 2.0429 -455.3848 131.010
116 2.0529 -455.3844 131.928
117 2.0629 -455.3841 132.819
118 2.0729 -455.3838 133.684
119 2.0830 -455.3835 134.523
120 2.0930 -455.3831 135.337
121 2.1030 -455.3828 136.127
122 2.1130 -455.3826 136.895
123 2.1231 -455.3823 137.640
124 2.1331 -455.3820 138.364
125 2.1431 -455.3817 139.068
126 2.1531 -455.3815 139.752
127 2.1632 -455.3812 140.417
128 2.1732 -455.3810 141.064
129 2.1832 -455.3807 141.694
130 2.1932 -455.3805 142.307
131 2.2033 -455.3803 142.903
132 2.2133 -455.3800 143.484
133 2.2233 -455.3798 144.050
134 2.2333 -455.3796 144.602
135 2.2434 -455.3794 145.140
136 2.2534 -455.3792 145.665
137 2.2634 -455.3790 146.177
138 2.2734 -455.3788 146.677
139 2.2835 -455.3786 147.166
140 2.2935 -455.3785 147.643
141 2.3035 -455.3783 148.110
142 2.3135 -455.3781 148.566
143 2.3236 -455.3779 149.013
144 2.3336 -455.3778 149.450
145 2.3436 -455.3776 149.877
146 2.3536 -455.3775 150.297
147 2.3637 -455.3773 150.707
148 2.3737 -455.3771 151.110
149 2.3837 -455.3770 151.502
150 2.3937 -455.3768 151.889
151 2.4038 -455.3767 152.277
152 2.4138 -455.3766 152.659
153 2.4238 -455.3764 153.033
154 2.4338 -455.3763 153.400
155 2.4439 -455.3761 153.760
156 2.4539 -455.3760 154.113
157 2.4639 -455.3759 154.412
158 2.4739 -455.3758 154.757
159 2.4840 -455.3756 155.101
160 2.4940 -455.3755 155.438
161 2.5040 -455.3754 155.767
162 2.5140 -455.3753 156.047
163 2.5241 -455.3751 156.369
164 2.5341 -455.3750 156.690
165 2.5441 -455.3749 157.002
166 2.5541 -455.3748 157.266
167 2.5642 -455.3747 157.571
168 2.5742 -455.3746 157.874
169 2.5842 -455.3745 158.171
170 2.5942 -455.3744 158.417
171 2.6043 -455.3742 158.706
172 2.6143 -455.3741 158.995
173 2.6243 -455.3740 159.277
174 2.6343 -455.3739 159.507
175 2.6444 -455.3738 159.782
176 2.6544 -455.3737 160.057
177 2.6644 -455.3736 160.326
178 2.6744 -455.3735 160.540
179 2.6845 -455.3734 160.803
180 2.6945 -455.3733 161.065
181 2.7045 -455.3733 161.281
182 2.7145 -455.3732 161.535
183 2.7246 -455.3731 161.789
184 2.7346 -455.3730 161.996
185 2.7446 -455.3729 162.241
186 2.7546 -455.3728 162.487
187 2.7647 -455.3727 162.685
188 2.7747 -455.3726 162.922
189 2.7847 -455.3726 163.160
190 2.7947 -455.3725 163.349
191 2.8048 -455.3724 163.578
192 2.8148 -455.3723 163.808
193 2.8248 -455.3722 163.989
194 2.8348 -455.3722 164.210
195 2.8449 -455.3721 164.433
196 2.8549 -455.3720 164.606
197 2.8649 -455.3719 164.820
198 2.8749 -455.3718 165.036
199 2.8850 -455.3718 165.200
200 2.8950 -455.3717 165.407
201 2.9050 -455.3716 165.616
202 2.9150 -455.3716 165.773
203 2.9251 -455.3715 165.973
204 2.9351 -455.3714 166.175
205 2.9451 -455.3713 166.325
206 2.9551 -455.3713 166.519
207 2.9652 -455.3712 166.714
208 2.9752 -455.3711 166.857
209 2.9852 -455.3711 167.044
210 2.9952 -455.3710 167.233
211 3.0053 -455.3709 167.370
212 3.0153 -455.3709 167.550
213 3.0253 -455.3708 167.734
214 3.0353 -455.3708 167.864
215 3.0454 -455.3707 168.038
216 3.0554 -455.3706 168.216
217 3.0654 -455.3706 168.339
218 3.0754 -455.3705 168.508
219 3.0855 -455.3704 168.680
220 3.0955 -455.3704 168.797
221 3.1055 -455.3703 168.960
222 3.1155 -455.3703 169.126
223 3.1256 -455.3702 169.237
224 3.1356 -455.3702 169.395
225 3.1456 -455.3701 169.555
226 3.1556 -455.3701 169.660
227 3.1657 -455.3700 169.813
228 3.1757 -455.3700 169.967
229 3.1857 -455.3699 170.067
230 3.1957 -455.3699 170.213
231 3.2058 -455.3698 170.363
232 3.2158 -455.3698 170.457
233 3.2258 -455.3697 170.599
234 3.2358 -455.3697 170.743
235 3.2459 -455.3696 170.832
236 3.2559 -455.3696 170.968
237 3.2659 -455.3695 171.108
238 3.2759 -455.3695 171.191
239 3.2860 -455.3694 171.323
240 3.2960 -455.3694 171.458
241 3.3060 -455.3694 171.536
242 3.3160 -455.3693 171.663
243 3.3261 -455.3693 171.793
244 3.3361 -455.3692 171.867
245 3.3461 -455.3692 171.989
246 3.3561 -455.3691 172.115
247 3.3662 -455.3691 172.184
248 3.3762 -455.3691 172.302
249 3.3862 -455.3690 172.387
250 3.3962 -455.3690 172.502
251 3.4063 -455.3689 172.621
252 3.4163 -455.3689 172.684
253 3.4263 -455.3689 172.795
254 3.4363 -455.3689 172.873
255 3.4464 -455.3688 172.982
256 3.4564 -455.3688 173.058
257 3.4664 -455.3687 173.165
258 3.4764 -455.3687 173.238
259 3.4865 -455.3687 173.342
260 3.4965 -455.3686 173.413
261 3.5065 -455.3686 173.515
262 3.5165 -455.3686 173.583
263 3.5266 -455.3685 173.682
264 3.5366 -455.3685 173.749
265 3.5466 -455.3685 173.845
266 3.5566 -455.3685 173.909
267 3.5667 -455.3684 174.004
268 3.5767 -455.3684 174.065
269 3.5867 -455.3684 174.158
270 3.5967 -455.3683 174.217
271 3.6068 -455.3683 174.307
272 3.6168 -455.3683 174.364
273 3.6268 -455.3683 174.452
274 3.6368 -455.3682 174.507
275 3.6469 -455.3682 174.594
276 3.6569 -455.3682 174.647
277 3.6669 -455.3681 174.731
278 3.6769 -455.3681 174.782
279 3.6870 -455.3681 174.864
280 3.6970 -455.3681 174.914
281 3.7070 -455.3680 174.994
282 3.7170 -455.3680 175.042
283 3.7271 -455.3680 175.121
284 3.7371 -455.3680 175.167
285 3.7471 -455.3679 175.245
286 3.7571 -455.3679 175.289
287 3.7672 -455.3679 175.365
288 3.7772 -455.3679 175.408
289 3.7872 -455.3679 175.482
290 3.7972 -455.3678 175.523
291 3.8073 -455.3678 175.596
292 3.8173 -455.3678 175.635
293 3.8273 -455.3678 175.707
294 3.8373 -455.3678 175.745
295 3.8474 -455.3677 175.815
296 3.8574 -455.3677 175.851
297 3.8674 -455.3677 175.920
298 3.8774 -455.3677 175.955
299 3.8875 -455.3677 176.022
300 3.8975 -455.3676 176.056
301 3.9075 -455.3676 176.121
302 3.9175 -455.3676 176.154
303 3.9276 -455.3676 176.218
304 3.9376 -455.3676 176.249
305 3.9476 -455.3675 176.312
306 3.9576 -455.3675 176.343
307 3.9677 -455.3675 176.405
308 3.9777 -455.3675 176.433
309 3.9877 -455.3675 176.494
310 3.9977 -455.3675 176.522
311 4.0078 -455.3674 176.581
312 4.0178 -455.3674 176.608
313 4.0278 -455.3674 176.667
314 4.0378 -455.3674 176.692
315 4.0479 -455.3674 176.750
316 4.0579 -455.3674 176.775
317 4.0679 -455.3673 176.832
318 4.0779 -455.3673 176.856
319 4.0880 -455.3673 176.912
320 4.0980 -455.3673 176.935
321 4.1080 -455.3673 176.990
322 4.1180 -455.3673 177.012
323 4.1281 -455.3673 177.067
324 4.1381 -455.3672 177.088
325 4.1481 -455.3672 177.141
326 4.1581 -455.3672 177.162
327 4.1682 -455.3672 177.214
328 4.1782 -455.3672 177.234
329 4.1882 -455.3672 177.286
330 4.1982 -455.3672 177.305
331 4.2083 -455.3671 177.355
332 4.2183 -455.3671 177.373
333 4.2283 -455.3671 177.424
334 4.2383 -455.3671 177.441
335 4.2484 -455.3671 177.490
336 4.2584 -455.3671 177.506
337 4.2684 -455.3671 177.555
338 4.2784 -455.3671 177.570
339 4.2885 -455.3670 177.618
340 4.2985 -455.3670 177.633
341 4.3085 -455.3670 177.680
342 4.3185 -455.3670 177.693
343 4.3286 -455.3670 177.740
344 4.3386 -455.3670 177.753
345 4.3486 -455.3670 177.799
346 4.3586 -455.3670 177.811
347 4.3687 -455.3670 177.856
348 4.3787 -455.3669 177.868
349 4.3887 -455.3669 177.912
350 4.3987 -455.3669 177.924
351 4.4088 -455.3669 177.968
352 4.4188 -455.3669 177.979
353 4.4288 -455.3669 178.022
354 4.4388 -455.3669 178.033
355 4.4489 -455.3669 178.076
356 4.4589 -455.3669 178.086
357 4.4689 -455.3669 178.128
358 4.4789 -455.3668 178.138
359 4.4890 -455.3668 178.180
360 4.4990 -455.3668 178.189
361 4.5090 -455.3668 178.231
362 4.5190 -455.3668 178.239
363 4.5291 -455.3668 178.280
364 4.5391 -455.3668 178.288
365 4.5491 -455.3668 178.329
366 4.5591 -455.3668 178.337
367 4.5692 -455.3668 178.377
368 4.5792 -455.3668 178.384
369 4.5892 -455.3667 178.424
370 4.5992 -455.3667 178.430
371 4.6093 -455.3667 178.470
372 4.6193 -455.3667 178.476
373 4.6293 -455.3667 178.515
374 4.6393 -455.3667 178.520
375 4.6494 -455.3667 178.559
376 4.6594 -455.3667 178.564
377 4.6694 -455.3667 178.602
378 4.6794 -455.3667 178.607
379 4.6895 -455.3667 178.644
380 4.6995 -455.3667 178.649
381 4.7095 -455.3666 178.686
382 4.7195 -455.3666 178.690
383 4.7296 -455.3666 178.726
384 4.7396 -455.3666 178.729
385 4.7496 -455.3666 178.766
386 4.7596 -455.3666 178.769
387 4.7697 -455.3666 178.804
388 4.7797 -455.3666 178.807
389 4.7897 -455.3666 178.842
390 4.7997 -455.3666 178.844
391 4.8098 -455.3666 178.880
392 4.8198 -455.3666 178.881
393 4.8298 -455.3666 178.916
394 4.8398 -455.3665 178.917
395 4.8499 -455.3665 178.952
396 4.8599 -455.3665 178.953
397 4.8699 -455.3665 178.987
398 4.8799 -455.3665 178.988
399 4.8900 -455.3665 179.021
400 4.9000 -455.3665 179.022