4-NO2PhN2+ HSO4-

n d, A Eh E, kJ/mol
39 min 1.0902 -1245.1674 0.000
99 max 1.3906 -1245.1430 64.166
100 min 1.3956 -1245.1445 60.143
605 max 3.9238 -1245.0993 178.953
693 min 4.3643 -1245.0981 182.070

n d, A Eh E, kJ/mol
1 0.9000 -1245.1346 86.257
2 0.9050 -1245.1366 80.816
3 0.9100 -1245.1386 75.603
4 0.9150 -1245.1405 70.621
5 0.9200 -1245.1423 65.860
6 0.9250 -1245.1441 61.312
7 0.9300 -1245.1457 56.973
8 0.9350 -1245.1473 52.838
9 0.9401 -1245.1488 48.901
10 0.9451 -1245.1502 45.156
11 0.9501 -1245.1516 41.598
12 0.9551 -1245.1529 38.222
13 0.9601 -1245.1541 35.022
14 0.9651 -1245.1552 31.995
15 0.9701 -1245.1563 29.133
16 0.9751 -1245.1573 26.434
17 0.9801 -1245.1583 23.893
18 0.9851 -1245.1592 21.505
19 0.9901 -1245.1601 19.266
20 0.9951 -1245.1609 17.171
21 1.0001 -1245.1616 15.218
22 1.0051 -1245.1623 13.400
23 1.0101 -1245.1630 11.715
24 1.0151 -1245.1635 10.160
25 1.0202 -1245.1641 8.730
26 1.0252 -1245.1646 7.422
27 1.0302 -1245.1650 6.230
28 1.0352 -1245.1654 5.158
29 1.0402 -1245.1658 4.195
30 1.0452 -1245.1661 3.338
31 1.0502 -1245.1664 2.584
32 1.0552 -1245.1667 1.935
33 1.0602 -1245.1669 1.386
34 1.0652 -1245.1671 0.931
35 1.0702 -1245.1672 0.571
36 1.0752 -1245.1673 0.299
37 1.0802 -1245.1674 0.116
38 1.0852 -1245.1674 0.016
39 1.0902 -1245.1674 0.000
40 1.0952 -1245.1674 0.061
41 1.1003 -1245.1673 0.201
42 1.1053 -1245.1673 0.413
43 1.1103 -1245.1671 0.699
44 1.1153 -1245.1670 1.053
45 1.1203 -1245.1669 1.476
46 1.1253 -1245.1667 1.965
47 1.1303 -1245.1665 2.511
48 1.1353 -1245.1662 3.124
49 1.1403 -1245.1660 3.795
50 1.1453 -1245.1657 4.516
51 1.1503 -1245.1654 5.297
52 1.1553 -1245.1651 6.129
53 1.1603 -1245.1647 7.006
54 1.1653 -1245.1644 7.937
55 1.1703 -1245.1640 8.910
56 1.1753 -1245.1636 9.932
57 1.1804 -1245.1632 10.992
58 1.1854 -1245.1628 12.087
59 1.1904 -1245.1624 13.225
60 1.1954 -1245.1619 14.398
61 1.2004 -1245.1615 15.604
62 1.2054 -1245.1610 16.843
63 1.2104 -1245.1605 18.111
64 1.2154 -1245.1600 19.407
65 1.2204 -1245.1595 20.730
66 1.2254 -1245.1590 22.076
67 1.2304 -1245.1585 23.444
68 1.2354 -1245.1580 24.835
69 1.2404 -1245.1574 26.244
70 1.2454 -1245.1569 27.669
71 1.2504 -1245.1563 29.105
72 1.2554 -1245.1558 30.546
73 1.2605 -1245.1552 32.001
74 1.2655 -1245.1547 33.468
75 1.2705 -1245.1541 34.936
76 1.2755 -1245.1536 36.397
77 1.2805 -1245.1530 37.867
78 1.2855 -1245.1524 39.331
79 1.2905 -1245.1519 40.789
80 1.2955 -1245.1513 42.224
81 1.3005 -1245.1508 43.662
82 1.3055 -1245.1502 45.073
83 1.3105 -1245.1497 46.477
84 1.3155 -1245.1492 47.844
85 1.3205 -1245.1487 49.205
86 1.3255 -1245.1482 50.520
87 1.3305 -1245.1477 51.815
88 1.3355 -1245.1472 53.092
89 1.3406 -1245.1467 54.313
90 1.3456 -1245.1463 55.525
91 1.3506 -1245.1458 56.676
92 1.3556 -1245.1454 57.815
93 1.3606 -1245.1450 58.907
94 1.3656 -1245.1446 59.956
95 1.3706 -1245.1443 60.673
96 1.3756 -1245.1440 61.598
97 1.3806 -1245.1436 62.494
98 1.3856 -1245.1433 63.343
99 1.3906 -1245.1430 64.166
100 1.3956 -1245.1445 60.143
101 1.4006 -1245.1443 60.766
102 1.4056 -1245.1440 61.390
103 1.4106 -1245.1438 61.999
104 1.4156 -1245.1436 62.592
105 1.4207 -1245.1434 63.170
106 1.4257 -1245.1431 63.733
107 1.4307 -1245.1429 64.280
108 1.4357 -1245.1427 64.813
109 1.4407 -1245.1425 65.332
110 1.4457 -1245.1423 65.837
111 1.4507 -1245.1422 66.329
112 1.4557 -1245.1420 66.808
113 1.4607 -1245.1418 67.275
114 1.4657 -1245.1416 67.730
115 1.4707 -1245.1414 68.174
116 1.4757 -1245.1413 68.606
117 1.4807 -1245.1411 69.029
118 1.4857 -1245.1410 69.441
119 1.4907 -1245.1408 69.843
120 1.4957 -1245.1407 70.237
121 1.5008 -1245.1405 70.622
122 1.5058 -1245.1404 70.998
123 1.5108 -1245.1402 71.366
124 1.5158 -1245.1401 71.727
125 1.5208 -1245.1400 72.083
126 1.5258 -1245.1398 72.429
127 1.5308 -1245.1397 72.769
128 1.5358 -1245.1396 73.105
129 1.5408 -1245.1394 73.434
130 1.5458 -1245.1393 73.758
131 1.5508 -1245.1392 74.076
132 1.5558 -1245.1391 74.391
133 1.5608 -1245.1390 74.699
134 1.5658 -1245.1388 75.005
135 1.5708 -1245.1387 75.305
136 1.5758 -1245.1386 75.604
137 1.5809 -1245.1385 75.897
138 1.5859 -1245.1384 76.189
139 1.5909 -1245.1383 76.476
140 1.5959 -1245.1382 76.762
141 1.6009 -1245.1381 77.043
142 1.6059 -1245.1380 77.325
143 1.6109 -1245.1379 77.601
144 1.6159 -1245.1378 77.878
145 1.6209 -1245.1376 78.151
146 1.6259 -1245.1375 78.424
147 1.6309 -1245.1374 78.693
148 1.6359 -1245.1373 78.963
149 1.6409 -1245.1372 79.227
150 1.6459 -1245.1371 79.494
151 1.6509 -1245.1370 79.755
152 1.6559 -1245.1369 80.018
153 1.6610 -1245.1368 80.276
154 1.6660 -1245.1367 80.537
155 1.6710 -1245.1366 80.788
156 1.6760 -1245.1365 81.044
157 1.6810 -1245.1364 81.303
158 1.6860 -1245.1363 81.560
159 1.6910 -1245.1363 81.820
160 1.6960 -1245.1362 82.079
161 1.7010 -1245.1361 82.341
162 1.7060 -1245.1360 82.602
163 1.7110 -1245.1359 82.866
164 1.7160 -1245.1358 83.130
165 1.7210 -1245.1357 83.393
166 1.7260 -1245.1356 83.658
167 1.7310 -1245.1354 83.923
168 1.7360 -1245.1353 84.191
169 1.7411 -1245.1352 84.458
170 1.7461 -1245.1351 84.727
171 1.7511 -1245.1350 84.995
172 1.7561 -1245.1349 85.267
173 1.7611 -1245.1348 85.538
174 1.7661 -1245.1347 85.810
175 1.7711 -1245.1346 86.084
176 1.7761 -1245.1345 86.358
177 1.7811 -1245.1344 86.634
178 1.7861 -1245.1343 86.911
179 1.7911 -1245.1342 87.188
180 1.7961 -1245.1341 87.467
181 1.8011 -1245.1340 87.747
182 1.8061 -1245.1339 88.029
183 1.8111 -1245.1338 88.311
184 1.8161 -1245.1337 88.594
185 1.8212 -1245.1336 88.879
186 1.8262 -1245.1335 89.165
187 1.8312 -1245.1333 89.451
188 1.8362 -1245.1332 89.740
189 1.8412 -1245.1331 90.028
190 1.8462 -1245.1330 90.319
191 1.8512 -1245.1329 90.610
192 1.8562 -1245.1328 90.903
193 1.8612 -1245.1327 91.196
194 1.8662 -1245.1326 91.491
195 1.8712 -1245.1325 91.786
196 1.8762 -1245.1323 92.083
197 1.8812 -1245.1322 92.380
198 1.8862 -1245.1321 92.679
199 1.8912 -1245.1320 92.979
200 1.8962 -1245.1319 93.280
201 1.9013 -1245.1318 93.581
202 1.9063 -1245.1317 93.884
203 1.9113 -1245.1315 94.187
204 1.9163 -1245.1314 94.492
205 1.9213 -1245.1313 94.797
206 1.9263 -1245.1312 95.104
207 1.9313 -1245.1311 95.410
208 1.9363 -1245.1310 95.719
209 1.9413 -1245.1308 96.027
210 1.9463 -1245.1307 96.337
211 1.9513 -1245.1306 96.646
212 1.9563 -1245.1305 96.958
213 1.9613 -1245.1304 97.269
214 1.9663 -1245.1302 97.581
215 1.9713 -1245.1301 97.894
216 1.9763 -1245.1300 98.208
217 1.9814 -1245.1299 98.522
218 1.9864 -1245.1298 98.837
219 1.9914 -1245.1296 99.152
220 1.9964 -1245.1295 99.468
221 2.0014 -1245.1294 99.784
222 2.0064 -1245.1293 100.101
223 2.0114 -1245.1292 100.418
224 2.0164 -1245.1290 100.736
225 2.0214 -1245.1289 101.054
226 2.0264 -1245.1288 101.373
227 2.0314 -1245.1287 101.692
228 2.0364 -1245.1286 102.011
229 2.0414 -1245.1284 102.331
230 2.0464 -1245.1283 102.651
231 2.0514 -1245.1282 102.971
232 2.0564 -1245.1281 103.292
233 2.0615 -1245.1279 103.643
234 2.0665 -1245.1278 103.933
235 2.0715 -1245.1277 104.255
236 2.0765 -1245.1276 104.576
237 2.0815 -1245.1275 104.897
238 2.0865 -1245.1273 105.248
239 2.0915 -1245.1272 105.541
240 2.0965 -1245.1271 105.863
241 2.1015 -1245.1270 106.184
242 2.1065 -1245.1268 106.506
243 2.1115 -1245.1267 106.853
244 2.1165 -1245.1266 107.150
245 2.1215 -1245.1265 107.472
246 2.1265 -1245.1264 107.794
247 2.1315 -1245.1262 108.116
248 2.1365 -1245.1261 108.438
249 2.1416 -1245.1260 108.759
250 2.1466 -1245.1259 109.081
251 2.1516 -1245.1257 109.403
252 2.1566 -1245.1256 109.723
253 2.1616 -1245.1255 110.045
254 2.1666 -1245.1254 110.366
255 2.1716 -1245.1253 110.686
256 2.1766 -1245.1251 111.008
257 2.1816 -1245.1250 111.330
258 2.1866 -1245.1249 111.648
259 2.1916 -1245.1248 111.969
260 2.1966 -1245.1246 112.289
261 2.2016 -1245.1245 112.608
262 2.2066 -1245.1244 112.928
263 2.2116 -1245.1243 113.247
264 2.2166 -1245.1242 113.576
265 2.2217 -1245.1240 113.884
266 2.2267 -1245.1239 114.203
267 2.2317 -1245.1238 114.521
268 2.2367 -1245.1237 114.838
269 2.2417 -1245.1236 115.155
270 2.2467 -1245.1234 115.472
271 2.2517 -1245.1233 115.793
272 2.2567 -1245.1232 116.105
273 2.2617 -1245.1231 116.421
274 2.2667 -1245.1230 116.736
275 2.2717 -1245.1228 117.052
276 2.2767 -1245.1227 117.365
277 2.2817 -1245.1226 117.679
278 2.2867 -1245.1225 117.997
279 2.2917 -1245.1224 118.306
280 2.2967 -1245.1222 118.619
281 2.3018 -1245.1221 118.931
282 2.3068 -1245.1220 119.243
283 2.3118 -1245.1219 119.554
284 2.3168 -1245.1218 119.865
285 2.3218 -1245.1216 120.186
286 2.3268 -1245.1215 120.485
287 2.3318 -1245.1214 120.794
288 2.3368 -1245.1213 121.103
289 2.3418 -1245.1212 121.410
290 2.3468 -1245.1211 121.718
291 2.3518 -1245.1209 122.037
292 2.3568 -1245.1208 122.331
293 2.3618 -1245.1207 122.637
294 2.3668 -1245.1206 122.942
295 2.3718 -1245.1205 123.248
296 2.3768 -1245.1204 123.551
297 2.3819 -1245.1202 123.856
298 2.3869 -1245.1201 124.160
299 2.3919 -1245.1200 124.459
300 2.3969 -1245.1199 124.760
301 2.4019 -1245.1198 125.062
302 2.4069 -1245.1197 125.383
303 2.4119 -1245.1196 125.661
304 2.4169 -1245.1194 125.960
305 2.4219 -1245.1193 126.258
306 2.4269 -1245.1192 126.556
307 2.4319 -1245.1191 126.852
308 2.4369 -1245.1190 127.149
309 2.4419 -1245.1189 127.447
310 2.4469 -1245.1188 127.738
311 2.4519 -1245.1186 128.033
312 2.4569 -1245.1185 128.326
313 2.4620 -1245.1184 128.620
314 2.4670 -1245.1183 128.910
315 2.4720 -1245.1182 129.202
316 2.4770 -1245.1181 129.492
317 2.4820 -1245.1180 129.818
318 2.4870 -1245.1179 130.071
319 2.4920 -1245.1178 130.360
320 2.4970 -1245.1177 130.646
321 2.5020 -1245.1175 130.934
322 2.5070 -1245.1174 131.219
323 2.5120 -1245.1173 131.504
324 2.5170 -1245.1172 131.788
325 2.5220 -1245.1171 132.090
326 2.5270 -1245.1170 132.354
327 2.5320 -1245.1169 132.637
328 2.5370 -1245.1168 132.917
329 2.5421 -1245.1167 133.198
330 2.5471 -1245.1166 133.476
331 2.5521 -1245.1165 133.755
332 2.5571 -1245.1164 134.032
333 2.5621 -1245.1163 134.310
334 2.5671 -1245.1162 134.586
335 2.5721 -1245.1160 134.904
336 2.5771 -1245.1159 135.135
337 2.5821 -1245.1158 135.409
338 2.5871 -1245.1157 135.681
339 2.5921 -1245.1156 135.958
340 2.5971 -1245.1155 136.224
341 2.6021 -1245.1154 136.495
342 2.6071 -1245.1153 136.764
343 2.6121 -1245.1152 137.033
344 2.6171 -1245.1151 137.299
345 2.6222 -1245.1150 137.567
346 2.6272 -1245.1149 137.832
347 2.6322 -1245.1148 138.128
348 2.6372 -1245.1147 138.361
349 2.6422 -1245.1146 138.625
350 2.6472 -1245.1145 138.886
351 2.6522 -1245.1144 139.148
352 2.6572 -1245.1143 139.409
353 2.6622 -1245.1142 139.675
354 2.6672 -1245.1141 139.928
355 2.6722 -1245.1140 140.185
356 2.6772 -1245.1139 140.443
357 2.6822 -1245.1138 140.697
358 2.6872 -1245.1137 140.954
359 2.6922 -1245.1136 141.206
360 2.6972 -1245.1135 141.460
361 2.7023 -1245.1134 141.720
362 2.7073 -1245.1133 141.963
363 2.7123 -1245.1132 142.215
364 2.7173 -1245.1131 142.474
365 2.7223 -1245.1131 142.712
366 2.7273 -1245.1130 142.961
367 2.7323 -1245.1129 143.209
368 2.7373 -1245.1128 143.453
369 2.7423 -1245.1127 143.698
370 2.7473 -1245.1126 143.942
371 2.7523 -1245.1125 144.191
372 2.7573 -1245.1124 144.428
373 2.7623 -1245.1123 144.670
374 2.7673 -1245.1122 144.910
375 2.7723 -1245.1121 145.161
376 2.7773 -1245.1120 145.389
377 2.7824 -1245.1119 145.627
378 2.7874 -1245.1119 145.864
379 2.7924 -1245.1118 146.132
380 2.7974 -1245.1117 146.334
381 2.8024 -1245.1116 146.569
382 2.8074 -1245.1115 146.803
383 2.8124 -1245.1114 147.082
384 2.8174 -1245.1113 147.266
385 2.8224 -1245.1112 147.497
386 2.8274 -1245.1111 147.727
387 2.8324 -1245.1110 147.999
388 2.8374 -1245.1110 148.182
389 2.8424 -1245.1109 148.410
390 2.8474 -1245.1108 148.638
391 2.8524 -1245.1107 148.860
392 2.8574 -1245.1106 149.085
393 2.8625 -1245.1105 149.307
394 2.8675 -1245.1105 149.534
395 2.8725 -1245.1104 149.752
396 2.8775 -1245.1103 149.973
397 2.8825 -1245.1102 150.246
398 2.8875 -1245.1101 150.411
399 2.8925 -1245.1100 150.629
400 2.8975 -1245.1100 150.846
401 2.9025 -1245.1099 151.104
402 2.9075 -1245.1098 151.278
403 2.9125 -1245.1097 151.493
404 2.9175 -1245.1096 151.706
405 2.9225 -1245.1095 151.956
406 2.9275 -1245.1095 152.130
407 2.9325 -1245.1094 152.342
408 2.9375 -1245.1093 152.554
409 2.9426 -1245.1092 152.761
410 2.9476 -1245.1092 152.970
411 2.9526 -1245.1091 153.177
412 2.9576 -1245.1090 153.406
413 2.9626 -1245.1089 153.589
414 2.9676 -1245.1088 153.795
415 2.9726 -1245.1088 154.000
416 2.9776 -1245.1087 154.202
417 2.9826 -1245.1086 154.405
418 2.9876 -1245.1085 154.609
419 2.9926 -1245.1085 154.808
420 2.9976 -1245.1084 155.008
421 3.0026 -1245.1083 155.207
422 3.0076 -1245.1082 155.408
423 3.0126 -1245.1081 155.604
424 3.0176 -1245.1081 155.801
425 3.0227 -1245.1080 155.997
426 3.0277 -1245.1079 156.192
427 3.0327 -1245.1078 156.387
428 3.0377 -1245.1078 156.581
429 3.0427 -1245.1077 156.786
430 3.0477 -1245.1076 156.965
431 3.0527 -1245.1076 157.157
432 3.0577 -1245.1075 157.348
433 3.0627 -1245.1074 157.608
434 3.0677 -1245.1073 157.725
435 3.0727 -1245.1073 157.914
436 3.0777 -1245.1072 158.100
437 3.0827 -1245.1071 158.287
438 3.0877 -1245.1071 158.473
439 3.0927 -1245.1070 158.662
440 3.0977 -1245.1069 158.842
441 3.1028 -1245.1068 159.025
442 3.1078 -1245.1068 159.207
443 3.1128 -1245.1067 159.389
444 3.1178 -1245.1066 159.572
445 3.1228 -1245.1065 159.808
446 3.1278 -1245.1065 159.930
447 3.1328 -1245.1064 160.109
448 3.1378 -1245.1064 160.291
449 3.1428 -1245.1063 160.464
450 3.1478 -1245.1062 160.641
451 3.1528 -1245.1062 160.818
452 3.1578 -1245.1061 161.000
453 3.1628 -1245.1060 161.165
454 3.1678 -1245.1060 161.339
455 3.1728 -1245.1059 161.512
456 3.1778 -1245.1058 161.718
457 3.1829 -1245.1058 161.854
458 3.1879 -1245.1057 162.025
459 3.1929 -1245.1056 162.198
460 3.1979 -1245.1056 162.363
461 3.2029 -1245.1055 162.531
462 3.2079 -1245.1054 162.698
463 3.2129 -1245.1054 162.865
464 3.2179 -1245.1053 163.036
465 3.2229 -1245.1053 163.203
466 3.2279 -1245.1052 163.360
467 3.2329 -1245.1051 163.523
468 3.2379 -1245.1051 163.687
469 3.2429 -1245.1050 163.856
470 3.2479 -1245.1049 164.009
471 3.2529 -1245.1049 164.170
472 3.2579 -1245.1048 164.341
473 3.2630 -1245.1048 164.489
474 3.2680 -1245.1047 164.647
475 3.2730 -1245.1046 164.804
476 3.2780 -1245.1046 164.961
477 3.2830 -1245.1045 165.120
478 3.2880 -1245.1045 165.272
479 3.2930 -1245.1044 165.427
480 3.2980 -1245.1043 165.581
481 3.3030 -1245.1043 165.788
482 3.3080 -1245.1042 165.886
483 3.3130 -1245.1042 166.037
484 3.3180 -1245.1041 166.187
485 3.3230 -1245.1041 166.338
486 3.3280 -1245.1040 166.487
487 3.3330 -1245.1039 166.636
488 3.3380 -1245.1039 166.785
489 3.3431 -1245.1038 166.939
490 3.3481 -1245.1038 167.076
491 3.3531 -1245.1037 167.222
492 3.3581 -1245.1037 167.368
493 3.3631 -1245.1036 167.517
494 3.3681 -1245.1036 167.653
495 3.3731 -1245.1035 167.796
496 3.3781 -1245.1034 167.940
497 3.3831 -1245.1034 168.078
498 3.3881 -1245.1033 168.218
499 3.3931 -1245.1033 168.359
500 3.3981 -1245.1032 168.498
501 3.4031 -1245.1032 168.633
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