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 561
scaling factor multiple (3)

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

Transitions

Frequency
[wavenumbers]
Wavelength
[microns]
Integrated cross-section
[km/mol]
Symmetry Scaling factor
3082 3.244 72.02 A1 0.9595
3082 3.244 390.5 B2 0.9595
3071 3.256 213.9 A1 0.9595
3071 3.256 71.93 B2 0.9595
3068 3.26 33.12 A1 0.9595
3068 3.26 15.75 B2 0.9595
3062 3.265 59.61 A1 0.9595
3060 3.268 24.91 B2 0.9595
3059 3.269 8.102 A1 0.9595
3059 3.269 41 B2 0.9595
3058 3.27 4.367 A1 0.9595
3057 3.272 24.23 B2 0.9595
3056 3.273 35.29 A1 0.9595
3056 3.273 56.1 B2 0.9595
3054 3.274 8.437 A1 0.9595
3054 3.274 21.53 B2 0.9595
3054 3.274 0.0015 A1 0.9595
3054 3.275 2.996 B2 0.9595
3053 3.275 96.01 A1 0.9595
3052 3.276 13.15 B2 0.9595
3052 3.277 27.57 A1 0.9595
3050 3.279 2.146 B2 0.9595
3049 3.28 0.0947 A1 0.9595
3048 3.281 0.87 B2 0.9595
1601 6.247 73.67 A1 0.9523
1596 6.265 1.481 B2 0.9523
1580 6.327 66.08 B2 0.9523
1576 6.345 131.2 A1 0.9523
1566 6.387 9.996 A1 0.9523
1565 6.389 0.2634 B2 0.9523
1560 6.412 3.174 A1 0.9523
1556 6.427 0.7915 B2 0.9523
1554 6.434 14.94 A1 0.9523
1550 6.453 73.29 B2 0.9523
1547 6.464 63.37 A1 0.9523
1541 6.489 0.1289 A1 0.9523
1541 6.491 0.0878 B2 0.9523
1534 6.517 16.23 A1 0.9523
1534 6.521 73.19 B2 0.9523
1530 6.536 58.24 A1 0.9523
1521 6.576 58.91 A1 0.9523
1518 6.586 2.087 B2 0.9523
1513 6.61 3.578 B2 0.9523
1510 6.621 41.33 A1 0.9523
1507 6.636 87.14 B2 0.9523
1506 6.642 58.29 A1 0.9523
1493 6.698 25.54 B2 0.9523
1482 6.747 51.4 A1 0.9523
1481 6.751 55.12 B2 0.9523
1474 6.783 18.81 B2 0.9523
1470 6.802 4.66 A1 0.9523
1465 6.827 25.14 B2 0.9523
1464 6.832 2.835 A1 0.9523
1459 6.855 50.66 A1 0.9523
1449 6.901 0.7155 B2 0.9523
1447 6.91 65.3 A1 0.9523
1444 6.928 0.3541 B2 0.9523
1440 6.945 1.883 B2 0.9523
1433 6.98 14.16 A1 0.9523
1429 6.998 62.96 A1 0.9523
1429 7 2.515 B2 0.9523
1424 7.023 53.86 B2 0.9523
1423 7.028 20.03 A1 0.9523
1418 7.052 0.4519 B2 0.9523
1414 7.074 6.273 B2 0.9523
1413 7.078 6.876 A1 0.9523
1410 7.091 4.605 A1 0.9523
1402 7.135 14.13 A1 0.9523
1398 7.154 7.696 B2 0.9523
1393 7.178 73.46 B2 0.9523
1390 7.192 36.99 A1 0.9523
1388 7.203 60.87 B2 0.9523
1385 7.22 84.63 A1 0.9523
1381 7.242 0.8006 A1 0.9523
1378 7.256 14.08 B2 0.9523
1377 7.262 5.602 A1 0.9523
1374 7.279 1.014 B2 0.9523
1371 7.293 1.673 A1 0.9523
1367 7.315 0.7545 B2 0.9523
1366 7.321 3.299 A1 0.9523
1365 7.326 0.0401 B2 0.9523
1359 7.36 0.0509 B2 0.9523
1356 7.372 0.4281 B2 0.9523
1355 7.382 0.9013 A1 0.9523
1353 7.393 4.001 A1 0.9523
1352 7.398 8.517 A1 0.9523
1349 7.413 6.92 B2 0.9523
1349 7.414 0.5333 A1 0.9523
1343 7.446 5.026 B2 0.9523
1341 7.458 1.048 A1 0.9523
1340 7.465 8.267 B2 0.9523
1333 7.5 12.12 B2 0.9523
1332 7.508 0.4434 B2 0.9523
1328 7.528 30.07 A1 0.9523
1318 7.585 12.35 A1 0.9523
1318 7.586 4.533 B2 0.9523
1314 7.608 9.227 A1 0.9523
1308 7.645 12.46 B2 0.9523
1305 7.663 26.34 B2 0.9523
1302 7.68 51.86 A1 0.9523
1298 7.705 0.546 B2 0.9523
1294 7.73 9.011 A1 0.9523
1285 7.785 30.04 A1 0.9523
1281 7.804 2.038 B2 0.9523
1277 7.831 0.2312 A1 0.9523
1270 7.875 21.88 A1 0.9523
1263 7.917 0.1483 B2 0.9523
1238 8.074 0.1178 A1 0.9523
1238 8.075 0.0222 B2 0.9523
1235 8.097 44.54 B2 0.9523
1230 8.13 20.15 A1 0.9523
1215 8.231 38.66 B2 0.9523
1205 8.298 1.856 A1 0.9523
1204 8.304 38.98 B2 0.9523
1202 8.319 15.2 A1 0.9523
1199 8.343 6.785 B2 0.9523
1196 8.358 26.67 A1 0.9523
1188 8.418 33.09 A1 0.9523
1187 8.424 1.466 B2 0.9523
1185 8.437 67.48 A1 0.9523
1185 8.438 36.92 B2 0.9523
1179 8.481 1.959 A1 0.9523
1174 8.52 0.186 B2 0.9523
1174 8.521 17.53 A1 0.9523
1171 8.541 1.498 B2 0.9523
1170 8.545 0.1115 A1 0.9523
1168 8.561 0.0299 B2 0.9523
1158 8.635 11.45 B2 0.9523
1151 8.69 39.39 B2 0.9523
1137 8.793 33.59 A1 0.9523
1130 8.849 55.94 A1 0.9523
1111 9.004 1.303 B2 0.9523
1102 9.073 3.021 A1 0.9523
1100 9.088 31.3 B2 0.9523
1069 9.355 20.17 A1 0.9523
1068 9.362 0.3722 B2 0.9523
1068 9.366 16.8 A1 0.9523
1065 9.392 16.55 B2 0.9523
1058 9.449 9.928 A1 0.9563
1044 9.577 0.4535 B2 0.9563
1030 9.712 11.35 A1 0.9563
1006 9.937 0.1064 B2 0.9563
995.3 10.05 8.476 A1 0.9563
981.3 10.19 2.28 B2 0.9563
974.5 10.26 0.0352 B1 0.9563
973.6 10.27 0 A2 0.9563
972.6 10.28 31.12 A1 0.9563
969.3 10.32 2.102 B1 0.9563
969.3 10.32 0 A2 0.9563
966.5 10.35 1.637 A1 0.9563
946.8 10.56 1.515 B2 0.9563
923.9 10.82 46.2 A1 0.9563
911.1 10.98 81.25 B1 0.9563
906.1 11.04 49.88 B2 0.9563
896.7 11.15 0 A2 0.9563
896 11.16 72.96 B1 0.9563
892.7 11.2 170.4 B1 0.9563
892 11.21 45.41 A1 0.9563
889.9 11.24 0 A2 0.9563
883.6 11.32 88.8 A1 0.9563
877.5 11.4 0 A2 0.9563
877 11.4 7.279 B1 0.9563
874.1 11.44 2.835 B2 0.9563
868.1 11.52 0.0064 B1 0.9563
865.5 11.55 0 A2 0.9563
855.4 11.69 0.3099 B2 0.9563
854.5 11.7 0 A2 0.9563
846.2 11.82 0.7702 B1 0.9563
836.4 11.96 0 A2 0.9563
836.2 11.96 6.951 B2 0.9563
824.3 12.13 17.53 B1 0.9563
818.4 12.22 7.066 A1 0.9563
816.8 12.24 0 A2 0.9563
814.4 12.28 0.6198 A1 0.9563
809.8 12.35 0.6194 B1 0.9563
799.4 12.51 0.9935 B2 0.9563
798.7 12.52 3.049 A1 0.9563
790.4 12.65 8.618 B1 0.9563
786.7 12.71 0 A2 0.9563
783.9 12.76 0.2541 B2 0.9563
782.7 12.78 0 A2 0.9563
777.3 12.87 0.0001 B1 0.9563
772.7 12.94 6.336 B1 0.9563
771.1 12.97 0 A2 0.9563
770.7 12.98 20.83 B2 0.9563
770.6 12.98 7.902 A1 0.9563
762.7 13.11 0 A2 0.9563
751.5 13.31 7.067 B1 0.9563
746.1 13.4 11.57 A1 0.9563
745 13.42 0 A2 0.9563
741.8 13.48 34.77 B1 0.9563
740.5 13.5 8.968 B2 0.9563
739.2 13.53 22.02 A1 0.9563
738.7 13.54 0 A2 0.9563
735.8 13.59 2.123 B1 0.9563
728.9 13.72 7.743 B1 0.9563
722.6 13.84 0.1071 B1 0.9563
718.6 13.92 0 A2 0.9563
715.2 13.98 0 A2 0.9563
714.8 13.99 31.64 B2 0.9563
713 14.03 1.736 B1 0.9563
710.4 14.08 13.45 A1 0.9563
709.1 14.1 4.884 B2 0.9563
704.3 14.2 0 A2 0.9563
702.4 14.24 6.575 B1 0.9563
694.7 14.4 0 A2 0.9563
694.6 14.4 1.958 B1 0.9563
691.9 14.45 24.97 A1 0.9563
682.8 14.65 0 A2 0.9563
680.8 14.69 0.0083 B1 0.9563
672.9 14.86 2.341 B2 0.9563
665.3 15.03 4.157 B1 0.9563
664.2 15.06 34.09 B2 0.9563
660.1 15.15 2.422 A1 0.9563
659.8 15.16 0 A2 0.9563
644.7 15.51 0.2196 B1 0.9563
638.7 15.66 0 A2 0.9563
636.8 15.7 1.688 B2 0.9563
635.2 15.74 0.0368 A1 0.9563
634.4 15.76 0.1602 B2 0.9563
621.4 16.09 6.424 B2 0.9563
619.7 16.14 0.1377 A1 0.9563
604.8 16.54 1.392 B1 0.9563
603.7 16.56 3.235 A1 0.9563
599.7 16.67 0.0001 B1 0.9563
599.3 16.68 1.912 B2 0.9563
593.8 16.84 2.188 A1 0.9563
593.1 16.86 0 A2 0.9563
586 17.07 24.22 B2 0.9563
580 17.24 0 A2 0.9563
577.5 17.31 0.1045 B1 0.9563
576.2 17.36 0 A2 0.9563
574.8 17.4 7.865 B1 0.9563
570.3 17.54 2.229 B2 0.9563
567.5 17.62 5.838 B1 0.9563
566.8 17.64 0.469 A1 0.9563
566 17.67 0 A2 0.9563
556 17.99 0.6289 B1 0.9563
555.2 18.01 0.051 A1 0.9563
552 18.11 0 A2 0.9563
551.8 18.12 4.785 B1 0.9563
546.7 18.29 30.49 B2 0.9563
539.8 18.52 0 A2 0.9563
533 18.76 26.14 A1 0.9563
530.3 18.86 2.203 A1 0.9563
529.9 18.87 5.92 B2 0.9563
520.4 19.21 0.142 B1 0.9563
518.8 19.28 0 A2 0.9563
515.9 19.38 2.264 A1 0.9563
514.2 19.45 0.081 B1 0.9563
510.5 19.59 1.235 B2 0.9563
490.2 20.4 28.24 A1 0.9563
483 20.7 2.413 B2 0.9563
467.5 21.39 0.2221 B2 0.9563
459.8 21.75 0 A2 0.9563
457.8 21.84 0.0085 A1 0.9563
445.3 22.46 0.0603 B1 0.9563
436.3 22.92 0.0332 B2 0.9563
431.5 23.18 8.383 B2 0.9563
429.8 23.26 4.881 A1 0.9563
422 23.7 0 A2 0.9563
420.3 23.79 31.37 A1 0.9563
419.8 23.82 1.654 B1 0.9563
412 24.27 0 A2 0.9563
400.5 24.97 0.0233 B1 0.9563
393.6 25.41 0 A2 0.9563
376 26.59 0.0743 B1 0.9563
373.9 26.75 0 A2 0.9563
366.5 27.28 7.044 B2 0.9563
362.6 27.58 0.2026 B1 0.9563
359.3 27.83 0 A2 0.9563
355 28.17 4.118 B2 0.9563
348.7 28.68 0.3924 B1 0.9563
333.5 29.99 0.3893 B2 0.9563
331.2 30.2 0 A2 0.9563
325.6 30.71 0 A2 0.9563
324.6 30.81 0.2891 B1 0.9563
324.5 30.82 35.62 A1 0.9563
316.9 31.56 3.87 A1 0.9563
316.4 31.6 1.976 B1 0.9563
300.2 33.32 0.0008 B1 0.9563
289.7 34.52 4.523 A1 0.9563
289.2 34.57 0 A2 0.9563
271.5 36.83 4.572 B2 0.9563
256.5 38.98 0 A2 0.9563
252.2 39.66 5.061 A1 0.9563
250.6 39.91 0 A2 0.9563
247.6 40.4 0.5341 B1 0.9563
244.4 40.92 0.1361 B1 0.9563
242.4 41.26 0 A2 0.9563
222.9 44.86 3.684 B1 0.9563
203.5 49.13 39.93 B2 0.9563
200 49.99 0 A2 0.9563
197.9 50.53 0.4987 B1 0.9563
192.7 51.9 0.1013 A1 0.9563
185.1 54.04 3.922 B2 0.9563
172.6 57.94 0.5491 B1 0.9563
171.6 58.29 0 A2 0.9563
155.9 64.14 0.1116 B1 0.9563
142.9 70 0 A2 0.9563
130.2 76.79 12.15 A1 0.9563
121.4 82.4 0.0962 B1 0.9563
119 84.01 0 A2 0.9563
109.8 91.11 0 A2 0.9563
96.5 103.6 0.6416 B1 0.9563
87.23 114.6 0.0751 B1 0.9563
58.78 170.1 0.3016 B1 0.9563
58.41 171.2 0 A2 0.9563
49.31 202.8 0 A2 0.9563
40.13 249.2 0.4796 B1 0.9563
21.49 465.3 0 A2 0.9563
21.39 467.5 0.1798 B1 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)