An older version of the theoretical database is currently selected, click here to switch to the latest
You need a browser with JavaScript support in order to view the molecule in 3D
uid 172
scaling factor multiple (3)

TransitionsLeft-clk & drag: Zoom; Right-clk: reset

Transitions

Frequency
[wavenumbers]
Wavelength
[microns]
Integrated cross-section
[km/mol]
Symmetry Scaling factor
3172 3.153 0 AG 0.9595
3160 3.165 2.964 B1U 0.9595
3159 3.165 0.5879 B2U 0.9595
3138 3.187 0 B3G 0.9595
3136 3.189 0 AG 0.9595
3127 3.198 0.0024 B1U 0.9595
3081 3.246 0 AG 0.9595
3081 3.246 182.1 B2U 0.9595
3081 3.246 0 AG 0.9595
3081 3.246 207.8 B1U 0.9595
3081 3.246 0 B3G 0.9595
3081 3.246 23.21 B2U 0.9595
3064 3.264 10.79 B1U 0.9595
3064 3.264 0 AG 0.9595
3063 3.264 0 B3G 0.9595
3063 3.264 44.35 B1U 0.9595
3063 3.265 37.03 B2U 0.9595
3062 3.266 0 B3G 0.9595
3062 3.266 0 AG 0.9595
3061 3.266 32.53 B1U 0.9595
3061 3.267 48.3 B2U 0.9595
3061 3.267 0 AG 0.9595
3060 3.268 0 B3G 0.9595
3060 3.268 1.929 B1U 0.9595
3059 3.269 0.2937 B2U 0.9595
3059 3.269 0 B3G 0.9595
3058 3.27 0 AG 0.9595
3058 3.27 0.0752 B2U 0.9595
3058 3.27 2.631 B1U 0.9595
3058 3.27 0 B3G 0.9595
1590 6.288 0 B3G 0.9523
1587 6.3 34.81 B1U 0.9523
1587 6.301 12.25 B2U 0.9523
1585 6.308 0 AG 0.9523
1581 6.325 0 B3G 0.9523
1581 6.326 0.1912 B1U 0.9523
1578 6.336 0 AG 0.9523
1577 6.34 27.21 B2U 0.9523
1572 6.363 0 AG 0.9523
1569 6.375 436.4 B2U 0.9523
1562 6.401 0 B3G 0.9523
1560 6.412 8.191 B1U 0.9523
1555 6.432 0 AG 0.9523
1551 6.449 2.238 B1U 0.9523
1548 6.459 0.1999 B1U 0.9523
1548 6.461 0 B3G 0.9523
1547 6.466 664.4 B2U 0.9523
1544 6.477 23.93 B2U 0.9523
1543 6.479 0 B3G 0.9523
1541 6.491 0 AG 0.9523
1524 6.562 0.3498 B1U 0.9523
1521 6.576 198.2 B2U 0.9523
1517 6.591 0 AG 0.9523
1514 6.604 0 B3G 0.9523
1489 6.717 1.69 B1U 0.9523
1483 6.743 0 AG 0.9523
1483 6.744 0 B3G 0.9523
1480 6.756 0 AG 0.9523
1479 6.763 11.16 B2U 0.9523
1477 6.77 4.919 B1U 0.9523
1470 6.802 0 AG 0.9523
1462 6.842 2.392 B1U 0.9523
1460 6.847 314.8 B2U 0.9523
1459 6.856 0 B3G 0.9523
1457 6.863 16.61 B2U 0.9523
1454 6.879 9.297 B1U 0.9523
1451 6.891 135.8 B2U 0.9523
1448 6.905 0 AG 0.9523
1448 6.907 0 B3G 0.9523
1437 6.961 1.21 B1U 0.9523
1437 6.961 0 AG 0.9523
1432 6.983 75.21 B2U 0.9523
1428 7.004 0 B3G 0.9523
1425 7.018 0 B3G 0.9523
1417 7.056 0 B3G 0.9523
1416 7.064 0 AG 0.9523
1415 7.066 96.6 B2U 0.9523
1415 7.067 0 B3G 0.9523
1413 7.08 0.2512 B1U 0.9523
1403 7.126 3.079 B2U 0.9523
1400 7.143 0.7112 B1U 0.9523
1394 7.173 0 AG 0.9523
1391 7.187 0 AG 0.9523
1391 7.187 0 B3G 0.9523
1389 7.199 0.0923 B2U 0.9523
1389 7.202 0.385 B1U 0.9523
1388 7.207 0.3454 B1U 0.9523
1382 7.234 4.848 B2U 0.9523
1380 7.244 0 AG 0.9523
1378 7.257 0 B3G 0.9523
1375 7.273 0 AG 0.9523
1367 7.315 13.08 B1U 0.9523
1365 7.325 0 B3G 0.9523
1363 7.336 0 AG 0.9523
1361 7.347 107.9 B2U 0.9523
1359 7.356 1.553 B1U 0.9523
1355 7.378 137.1 B2U 0.9523
1355 7.378 0 B3G 0.9523
1350 7.408 0 B3G 0.9523
1349 7.411 0 AG 0.9523
1344 7.441 1.444 B1U 0.9523
1342 7.451 0.6281 B2U 0.9523
1339 7.467 0 AG 0.9523
1337 7.48 66.15 B2U 0.9523
1333 7.505 15.03 B1U 0.9523
1328 7.529 0 B3G 0.9523
1323 7.56 0.1564 B1U 0.9523
1316 7.6 0 B3G 0.9523
1314 7.608 70.74 B2U 0.9523
1312 7.623 14.04 B1U 0.9523
1308 7.644 216.9 B2U 0.9523
1306 7.658 0 AG 0.9523
1302 7.683 0 AG 0.9523
1300 7.695 0 AG 0.9523
1299 7.699 0 B3G 0.9523
1298 7.704 23.83 B2U 0.9523
1287 7.768 0 B3G 0.9523
1282 7.798 43.07 B1U 0.9523
1282 7.803 1.103 B2U 0.9523
1270 7.873 0 B3G 0.9523
1269 7.878 0 AG 0.9523
1267 7.893 4.212 B1U 0.9523
1263 7.92 0 AG 0.9523
1261 7.931 126.8 B2U 0.9523
1251 7.991 426.6 B2U 0.9523
1234 8.104 0 B3G 0.9523
1234 8.104 18.24 B2U 0.9523
1234 8.106 0 AG 0.9523
1233 8.113 25.15 B1U 0.9523
1230 8.127 0 AG 0.9523
1218 8.211 0 B3G 0.9523
1215 8.233 0.4353 B1U 0.9523
1199 8.34 33.66 B2U 0.9523
1194 8.378 0 AG 0.9523
1192 8.387 0.1636 B1U 0.9523
1192 8.391 55.07 B2U 0.9523
1191 8.396 0 B3G 0.9523
1190 8.405 0 AG 0.9523
1187 8.422 0 B3G 0.9523
1186 8.43 61.05 B1U 0.9523
1179 8.481 329.6 B2U 0.9523
1176 8.506 0 AG 0.9523
1154 8.666 0 AG 0.9523
1153 8.676 0 B3G 0.9523
1143 8.748 230.6 B2U 0.9523
1143 8.751 24.63 B1U 0.9523
1142 8.754 183.9 B2U 0.9523
1123 8.903 0 AG 0.9523
1105 9.049 22.38 B2U 0.9523
1100 9.093 0 B3G 0.9523
1097 9.117 0.1537 B1U 0.9523
1091 9.164 4.942 B1U 0.9523
1090 9.174 2.75 B2U 0.9523
1065 9.392 0 AG 0.9523
1064 9.399 0 B3G 0.9523
1057 9.456 0 B3G 0.9563
1053 9.499 0 AG 0.9563
1051 9.512 0.0165 B1U 0.9563
1039 9.626 0.0858 B2U 0.9563
1038 9.636 7.172 B1U 0.9563
1032 9.687 0 B3G 0.9563
982.9 10.17 0 B2G 0.9563
982.7 10.18 0.1006 B3U 0.9563
982.2 10.18 0 AU 0.9563
981.9 10.18 0 B1G 0.9563
980.7 10.2 0 B2G 0.9563
980.6 10.2 0 AU 0.9563
942.2 10.61 0 B3G 0.9563
939.9 10.64 0 AG 0.9563
938.8 10.65 0 AG 0.9563
937.7 10.66 4.343 B2U 0.9563
936.4 10.68 7.856 B1U 0.9563
933.6 10.71 24.77 B2U 0.9563
926.9 10.79 0.0264 B1U 0.9563
921.5 10.85 277.6 B3U 0.9563
920.1 10.87 0 AG 0.9563
919.9 10.87 0 B1G 0.9563
918.7 10.88 0 B2G 0.9563
915.4 10.92 0 AU 0.9563
913.7 10.94 7.122 B3U 0.9563
911.6 10.97 0 B2G 0.9563
904.4 11.06 0 AG 0.9563
903.7 11.07 0 B3G 0.9563
899.5 11.12 5.702 B2U 0.9563
899.2 11.12 12.35 B1U 0.9563
881.2 11.35 80.46 B3U 0.9563
881.1 11.35 0 B1G 0.9563
876.7 11.41 0.2481 B3U 0.9563
875.8 11.42 0 AU 0.9563
871.8 11.47 0 B2G 0.9563
867.3 11.53 0 B2G 0.9563
866.4 11.54 0 B1G 0.9563
865.2 11.56 0 B1G 0.9563
861.8 11.6 0 AU 0.9563
859.7 11.63 3.013 B3U 0.9563
856.6 11.67 0 AU 0.9563
853.7 11.71 0 B2G 0.9563
813.4 12.29 10.47 B1U 0.9563
813.4 12.29 0.052 B2U 0.9563
806.5 12.4 0 B3G 0.9563
806.3 12.4 77.31 B3U 0.9563
803.3 12.45 0 B3G 0.9563
802.1 12.47 0 B1G 0.9563
801.2 12.48 0 B2G 0.9563
800.9 12.49 0.0428 B1U 0.9563
797.5 12.54 0 AG 0.9563
794.2 12.59 0.2722 B3U 0.9563
792.3 12.62 0 AU 0.9563
789.3 12.67 0 B1G 0.9563
783.7 12.76 0 B2G 0.9563
783.2 12.77 0 AU 0.9563
782.3 12.78 0.03 B3U 0.9563
780.3 12.82 0 B2G 0.9563
775.7 12.89 0 B1G 0.9563
771.3 12.97 0 AU 0.9563
765 13.07 8.48 B3U 0.9563
754.9 13.25 0 B2G 0.9563
754.8 13.25 0 B1G 0.9563
753.3 13.28 0 B3G 0.9563
752.7 13.28 0 AG 0.9563
750.3 13.33 0.248 B1U 0.9563
750.3 13.33 0.0122 B2U 0.9563
745.7 13.41 0.674 B2U 0.9563
741.5 13.49 0 B3G 0.9563
738.5 13.54 0.0051 B3U 0.9563
737.9 13.55 0 AU 0.9563
731.7 13.67 0.03 B1U 0.9563
729.1 13.72 0 B3G 0.9563
728.8 13.72 0 AG 0.9563
726.3 13.77 0 B2G 0.9563
714 14.01 0 AU 0.9563
708.4 14.12 0 B2G 0.9563
707.4 14.14 0 B1G 0.9563
690 14.49 0.006 B3U 0.9563
687.9 14.54 0 AU 0.9563
684.4 14.61 0 B1G 0.9563
677.7 14.76 2.403 B1U 0.9563
677.4 14.76 0.8765 B2U 0.9563
662.2 15.1 0 B2G 0.9563
657.1 15.22 0 B3G 0.9563
653.5 15.3 0.0835 B3U 0.9563
650.7 15.37 0 AU 0.9563
649.9 15.39 3.507 B1U 0.9563
649.3 15.4 3.367 B2U 0.9563
645.7 15.49 20.65 B3U 0.9563
637.1 15.7 0 B1G 0.9563
636.6 15.71 0 B2G 0.9563
634.9 15.75 0 AG 0.9563
622.5 16.06 0 B3G 0.9563
621.6 16.09 0 B3G 0.9563
620.1 16.13 0.017 B2U 0.9563
609.8 16.4 0 AG 0.9563
606.6 16.49 0 B1G 0.9563
605.6 16.51 0 B2G 0.9563
605.1 16.53 0 B3G 0.9563
594.9 16.81 21.53 B3U 0.9563
588.8 16.98 0 AU 0.9563
588.7 16.99 3.625 B2U 0.9563
588.2 17 15.05 B1U 0.9563
587.6 17.02 1.088 B3U 0.9563
581.1 17.21 0 AU 0.9563
575.1 17.39 0 AG 0.9563
570 17.54 0 B2G 0.9563
569.9 17.55 0 B1G 0.9563
567.8 17.61 0 AG 0.9563
563 17.76 0 B1G 0.9563
558.9 17.89 0.0006 B1U 0.9563
558.2 17.92 0 B3G 0.9563
557.4 17.94 0 B2G 0.9563
553.9 18.05 0.0577 B3U 0.9563
551.9 18.12 0 AU 0.9563
546.6 18.3 0 AG 0.9563
542.2 18.44 1.219 B2U 0.9563
541.7 18.46 0.3929 B2U 0.9563
541.3 18.48 0.0007 B1U 0.9563
538.5 18.57 0 B3G 0.9563
531.9 18.8 0.1353 B1U 0.9563
521.5 19.18 0 AG 0.9563
519.6 19.25 0 B3G 0.9563
500.6 19.98 0 B2G 0.9563
498.7 20.05 1.29 B1U 0.9563
497.3 20.11 3.223 B2U 0.9563
496.1 20.16 0.0414 B3U 0.9563
490.2 20.4 0 AU 0.9563
480.5 20.81 3.247 B3U 0.9563
476 21.01 0 B1G 0.9563
475.3 21.04 0 AG 0.9563
474.7 21.07 0 B2G 0.9563
473.7 21.11 0 AG 0.9563
467.1 21.41 0.7201 B2U 0.9563
465.4 21.49 3.571 B1U 0.9563
443.4 22.55 0 B3G 0.9563
439.6 22.75 0 AU 0.9563
428.2 23.36 4.967 B2U 0.9563
428 23.36 0 B2G 0.9563
425.7 23.49 0 B1G 0.9563
414 24.16 0 B2G 0.9563
410.7 24.35 0 B3G 0.9563
409.5 24.42 0 AU 0.9563
408.4 24.49 0 B1G 0.9563
401.1 24.93 0.4299 B2U 0.9563
400.5 24.97 5.732 B1U 0.9563
393.3 25.42 0 B3G 0.9563
386.8 25.85 0.0198 B3U 0.9563
385.1 25.97 0 AU 0.9563
372.7 26.83 0.0015 B3U 0.9563
370.5 26.99 0 AU 0.9563
369.1 27.09 0.0471 B1U 0.9563
355.3 28.14 0 AG 0.9563
352.5 28.37 0 B3G 0.9563
352.4 28.37 0 B1G 0.9563
345.1 28.98 4.21 B3U 0.9563
341.8 29.25 0 B2G 0.9563
315.1 31.74 0 B2G 0.9563
313.5 31.9 0 B1G 0.9563
304.9 32.8 0 B1G 0.9563
283.2 35.32 0.0014 B3U 0.9563
282.6 35.38 0 AG 0.9563
279.2 35.81 0 AU 0.9563
266.5 37.52 0.018 B1U 0.9563
249.8 40.03 0.0118 B3U 0.9563
248.6 40.23 0 AU 0.9563
246.8 40.51 7.131 B2U 0.9563
232.2 43.06 0 B3G 0.9563
227.7 43.91 0 B1G 0.9563
227.4 43.97 0 B2G 0.9563
214.5 46.62 0 B2G 0.9563
205.2 48.73 0 AG 0.9563
205.1 48.76 11.41 B1U 0.9563
204.5 48.91 3.427 B2U 0.9563
192.9 51.83 5.8 B3U 0.9563
186.6 53.6 0 B2G 0.9563
186 53.76 0.0905 B3U 0.9563
184.7 54.14 0 AU 0.9563
181.4 55.12 0 AU 0.9563
174.6 57.28 0 B2G 0.9563
174 57.46 0 B1G 0.9563
166.5 60.07 0 B1G 0.9563
140.7 71.1 6.442 B3U 0.9563
129.1 77.48 0 AG 0.9563
123 81.28 0 B1G 0.9563
122.1 81.92 0 B2G 0.9563
110 90.88 0.0069 B3U 0.9563
107.4 93.11 0 AU 0.9563
86.2 116 0.0134 B3U 0.9563
85.46 117 0 AU 0.9563
64.02 156.2 0 B3G 0.9563
58.48 171 0 B2G 0.9563
47.86 209 0 B1G 0.9563
43.53 229.7 0 B1G 0.9563
43.45 230.2 0 B2G 0.9563
25.18 397.2 0.062 B3U 0.9563
24.49 408.3 0 AU 0.9563
15.75 635 1.869 B3U 0.9563

Vibrations

Note(s):


You are kindly asked to consider the following references for citation when using the database:


3,139 species present in version 3.00 of the theoretical database (Aug 18, 2017)