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 766
scaling factor multiple (3)

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

Transitions

Frequency
[wavenumbers]
Wavelength
[microns]
Integrated cross-section
[km/mol]
Symmetry Scaling factor
3113 3.213 0 AG 0.9595
3113 3.213 317.5 B1U 0.9595
3113 3.213 101.8 B2U 0.9595
3113 3.213 0 B3G 0.9595
3093 3.233 0 AG 0.9595
3093 3.233 0.2438 B1U 0.9595
3093 3.233 4.365 B2U 0.9595
3093 3.233 0 B3G 0.9595
3071 3.257 0 AG 0.9595
3071 3.257 254.4 B2U 0.9595
3058 3.27 0 AG 0.9595
3058 3.27 271.4 B1U 0.9595
3058 3.27 136.4 B2U 0.9595
3058 3.27 0 B3G 0.9595
3057 3.271 0 AG 0.9595
3057 3.271 0.1762 B1U 0.9595
3056 3.272 15.59 B2U 0.9595
3056 3.272 0 B3G 0.9595
3054 3.275 8.542 B1U 0.9595
3054 3.275 0 B3G 0.9595
3053 3.275 0 AG 0.9595
3053 3.275 105.5 B2U 0.9595
3051 3.278 14.74 B1U 0.9595
3051 3.278 0 AG 0.9595
3051 3.278 0 B3G 0.9595
3051 3.278 0.035 B1U 0.9595
3050 3.279 0 AG 0.9595
3050 3.279 8.843 B2U 0.9595
3048 3.281 0.2047 B1U 0.9595
3048 3.281 0 B3G 0.9595
1606 6.226 0 AG 0.9523
1605 6.231 18.03 B2U 0.9523
1604 6.236 5.215 B1U 0.9523
1600 6.25 0 AG 0.9523
1599 6.255 0 B3G 0.9523
1594 6.272 0.6997 B2U 0.9523
1594 6.275 6.869 B1U 0.9523
1589 6.293 0 B3G 0.9523
1585 6.307 0 AG 0.9523
1579 6.332 72.99 B1U 0.9523
1577 6.341 38.83 B2U 0.9523
1574 6.351 1.797 B1U 0.9523
1574 6.351 0 B3G 0.9523
1574 6.353 0 B3G 0.9523
1572 6.36 0 AG 0.9523
1572 6.36 14.01 B2U 0.9523
1567 6.382 10.69 B1U 0.9523
1564 6.395 0 AG 0.9523
1564 6.395 0 B3G 0.9523
1563 6.397 21.98 B2U 0.9523
1563 6.398 2.939 B1U 0.9523
1561 6.408 0 B3G 0.9523
1557 6.423 0 AG 0.9523
1552 6.441 0.2145 B1U 0.9523
1550 6.452 0 B3G 0.9523
1549 6.458 0 AG 0.9523
1548 6.46 0.0632 B2U 0.9523
1540 6.495 0 B3G 0.9523
1538 6.501 2.076 B2U 0.9523
1538 6.501 0.2098 B1U 0.9523
1534 6.518 0 AG 0.9523
1522 6.569 0 B3G 0.9523
1521 6.577 2.38 B2U 0.9523
1514 6.607 0.9077 B1U 0.9523
1513 6.609 0 AG 0.9523
1506 6.639 0 AG 0.9523
1505 6.644 15.63 B1U 0.9523
1504 6.65 6.344 B2U 0.9523
1503 6.654 0 B3G 0.9523
1497 6.68 3.434 B2U 0.9523
1496 6.682 0.0043 B1U 0.9523
1495 6.69 0 AG 0.9523
1486 6.73 0.8521 B2U 0.9523
1483 6.741 0 B3G 0.9523
1481 6.752 0 AG 0.9523
1480 6.755 11.02 B1U 0.9523
1473 6.787 2.538 B2U 0.9523
1472 6.793 0 B3G 0.9523
1469 6.806 1.892 B1U 0.9523
1465 6.826 3.018 B2U 0.9523
1464 6.83 0 AG 0.9523
1463 6.838 0 B3G 0.9523
1458 6.858 0 AG 0.9523
1458 6.859 1.191 B1U 0.9523
1457 6.861 0 B3G 0.9523
1456 6.867 0 AG 0.9523
1450 6.895 4.012 B1U 0.9523
1450 6.898 0 B3G 0.9523
1449 6.904 2.496 B2U 0.9523
1438 6.954 0 B3G 0.9523
1437 6.959 1.154 B2U 0.9523
1436 6.962 0 AG 0.9523
1436 6.965 0 AG 0.9523
1433 6.978 0 B3G 0.9523
1432 6.984 0.0548 B2U 0.9523
1431 6.988 3.316 B1U 0.9523
1427 7.007 0.058 B1U 0.9523
1426 7.013 3.372 B2U 0.9523
1423 7.03 2.916 B1U 0.9523
1421 7.037 0 AG 0.9523
1416 7.061 0 B3G 0.9523
1414 7.074 1.111 B2U 0.9523
1412 7.082 1.813 B1U 0.9523
1411 7.088 0 B3G 0.9523
1410 7.093 0 AG 0.9523
1403 7.13 4.718 B2U 0.9523
1401 7.136 0 AG 0.9523
1401 7.14 0.5416 B1U 0.9523
1399 7.148 0 B3G 0.9523
1396 7.162 11.98 B1U 0.9523
1395 7.168 7.692 B2U 0.9523
1393 7.178 0 B3G 0.9523
1388 7.202 0 AG 0.9523
1388 7.203 1.075 B1U 0.9523
1388 7.206 0 B3G 0.9523
1386 7.215 0 AG 0.9523
1384 7.227 0.2788 B2U 0.9523
1379 7.252 0 B3G 0.9523
1379 7.253 0.9764 B2U 0.9523
1377 7.263 12.05 B1U 0.9523
1376 7.269 4.388 B2U 0.9523
1373 7.282 0 AG 0.9523
1373 7.284 0.9351 B1U 0.9523
1373 7.285 0 AG 0.9523
1372 7.287 0.9298 B2U 0.9523
1371 7.292 0 B3G 0.9523
1367 7.316 0 B3G 0.9523
1367 7.318 0.102 B2U 0.9523
1364 7.329 4.539 B1U 0.9523
1363 7.338 0.1507 B2U 0.9523
1362 7.344 0 AG 0.9523
1360 7.352 0 B3G 0.9523
1358 7.362 0.1786 B1U 0.9523
1357 7.369 0.0001 B2U 0.9523
1356 7.375 0 B3G 0.9523
1354 7.387 0.0007 B1U 0.9523
1353 7.389 0 AG 0.9523
1352 7.398 0 AG 0.9523
1351 7.401 0 B3G 0.9523
1350 7.408 1.374 B2U 0.9523
1346 7.427 0.3107 B1U 0.9523
1346 7.431 0 B3G 0.9523
1345 7.433 0 AG 0.9523
1345 7.438 0.079 B2U 0.9523
1342 7.45 0 B3G 0.9523
1342 7.451 0 AG 0.9523
1339 7.471 3.231 B2U 0.9523
1336 7.488 0 AG 0.9523
1331 7.513 13.63 B1U 0.9523
1330 7.518 0 B2U 0.9523
1328 7.53 0 B3G 0.9523
1323 7.558 0.2163 B1U 0.9523
1321 7.568 16.62 B2U 0.9523
1319 7.579 15.47 B1U 0.9523
1319 7.582 0 AG 0.9523
1318 7.585 4.296 B2U 0.9523
1314 7.609 0 B3G 0.9523
1311 7.628 2.966 B1U 0.9523
1310 7.635 0 AG 0.9523
1305 7.663 0 AG 0.9523
1302 7.681 0 B3G 0.9523
1299 7.696 0 AG 0.9523
1298 7.704 1.818 B1U 0.9523
1298 7.706 1.613 B2U 0.9523
1294 7.728 1.987 B1U 0.9523
1290 7.753 0 B3G 0.9523
1289 7.758 5.092 B2U 0.9523
1282 7.801 0 AG 0.9523
1281 7.808 1.622 B2U 0.9523
1277 7.828 1.064 B1U 0.9523
1274 7.848 0 B3G 0.9523
1271 7.866 0 AG 0.9523
1265 7.906 0 AG 0.9523
1262 7.922 0.0573 B2U 0.9523
1258 7.949 23.98 B1U 0.9523
1254 7.978 0 B3G 0.9523
1253 7.983 0 AG 0.9523
1248 8.015 41.73 B2U 0.9523
1233 8.11 32.16 B1U 0.9523
1231 8.125 2.98 B2U 0.9523
1231 8.126 0 AG 0.9523
1228 8.144 0 B3G 0.9523
1223 8.176 0.0077 B2U 0.9523
1218 8.211 0.5863 B1U 0.9523
1217 8.214 0 AG 0.9523
1207 8.286 8.311 B2U 0.9523
1206 8.292 0 B3G 0.9523
1205 8.297 45.68 B1U 0.9523
1198 8.344 0 B3G 0.9523
1196 8.36 0 AG 0.9523
1194 8.373 4.622 B1U 0.9523
1192 8.388 0 B3G 0.9523
1191 8.399 0 AG 0.9523
1188 8.417 1.085 B2U 0.9523
1182 8.461 0 AG 0.9523
1179 8.483 0 B3G 0.9523
1178 8.492 19.86 B2U 0.9523
1177 8.493 4.418 B1U 0.9523
1172 8.534 0 B3G 0.9523
1170 8.548 0 AG 0.9523
1167 8.572 0 B3G 0.9523
1166 8.577 0.0448 B1U 0.9523
1159 8.629 0 AG 0.9523
1158 8.636 1.189 B2U 0.9523
1146 8.726 2.554 B2U 0.9523
1146 8.728 0.8681 B1U 0.9523
1143 8.748 4.908 B2U 0.9523
1142 8.758 0 AG 0.9523
1122 8.912 0.0474 B1U 0.9523
1120 8.926 0 B3G 0.9523
1115 8.965 0 AG 0.9523
1115 8.969 5.073 B2U 0.9523
1109 9.021 12.08 B2U 0.9523
1104 9.062 2.712 B1U 0.9523
1096 9.122 0 B3G 0.9523
1081 9.251 0 AG 0.9523
1079 9.27 1.612 B1U 0.9523
1074 9.311 0 B3G 0.9523
1071 9.341 10.48 B2U 0.9523
1063 9.411 0 AG 0.9523
1061 9.424 3.017 B1U 0.9563
1058 9.452 10.78 B2U 0.9563
1050 9.523 0 B3G 0.9563
1029 9.72 0 B3G 0.9563
1028 9.73 5.735 B1U 0.9563
1020 9.803 0 AG 0.9563
1019 9.811 0 AG 0.9563
1012 9.882 7.178 B2U 0.9563
996.3 10.04 0 B3G 0.9563
990.8 10.09 0.3925 B2U 0.9563
978.2 10.22 0 AG 0.9563
975.8 10.25 0 B2G 0.9563
975.8 10.25 0 AU 0.9563
972.3 10.28 1.39 B1U 0.9563
969.5 10.31 5.948 B3U 0.9563
969.4 10.32 0 B2G 0.9563
967.8 10.33 0 B1G 0.9563
967.8 10.33 0 AU 0.9563
963 10.38 0 B3G 0.9563
959.6 10.42 0 B3G 0.9563
957.6 10.44 0 B2G 0.9563
957.6 10.44 0.2556 B3U 0.9563
954.5 10.48 0 AU 0.9563
954.5 10.48 0 B1G 0.9563
950.4 10.52 1.808 B2U 0.9563
939.5 10.64 0 AG 0.9563
936.7 10.68 5.9 B1U 0.9563
916.8 10.91 3.014 B1U 0.9563
915.3 10.93 2.934 B2U 0.9563
907.4 11.02 213.8 B3U 0.9563
907.3 11.02 0 B1G 0.9563
906 11.04 0.7893 B1U 0.9563
902.2 11.08 0 B2G 0.9563
901.9 11.09 0 AU 0.9563
891.7 11.21 10.37 B2U 0.9563
891 11.22 0 AG 0.9563
887.5 11.27 68.91 B3U 0.9563
887.4 11.27 0 B2G 0.9563
886 11.29 3.98 B1U 0.9563
877.7 11.39 0 B3G 0.9563
867.3 11.53 0 B3G 0.9563
865.7 11.55 0 B1G 0.9563
865.6 11.55 1.433 B3U 0.9563
863.2 11.58 0 AG 0.9563
856.1 11.68 0 B3G 0.9563
855.8 11.68 0 AU 0.9563
855.8 11.69 0 B2G 0.9563
851 11.75 4.618 B2U 0.9563
837.7 11.94 0.5479 B1U 0.9563
830.1 12.05 0 AG 0.9563
823.3 12.15 0 B2G 0.9563
820 12.19 10.03 B2U 0.9563
817.1 12.24 0 AG 0.9563
816.9 12.24 0 B3G 0.9563
816.6 12.25 0 AU 0.9563
816.5 12.25 0 B1G 0.9563
816.1 12.25 6.262 B1U 0.9563
815.2 12.27 3.928 B3U 0.9563
803 12.45 0 B2G 0.9563
802.2 12.47 0 B1G 0.9563
800.3 12.5 3.799 B1U 0.9563
799.7 12.51 0 AU 0.9563
799.2 12.51 0 B3G 0.9563
794.8 12.58 114.4 B3U 0.9563
788.5 12.68 0 B2G 0.9563
787.7 12.7 0 B1G 0.9563
784 12.75 24.39 B3U 0.9563
783.8 12.76 0 AU 0.9563
783.2 12.77 0.4044 B1U 0.9563
782.7 12.78 0 AG 0.9563
782.7 12.78 7.136 B2U 0.9563
780.4 12.81 4.838 B3U 0.9563
774.7 12.91 0 B1G 0.9563
773.4 12.93 0 AG 0.9563
772.9 12.94 0 B2G 0.9563
771.6 12.96 0 B2G 0.9563
767.5 13.03 14.23 B3U 0.9563
766.3 13.05 0 AU 0.9563
760.9 13.14 0 B2G 0.9563
760.5 13.15 0.8689 B2U 0.9563
759.5 13.17 0 B1G 0.9563
755.5 13.24 0 AU 0.9563
754.8 13.25 0.0104 B3U 0.9563
754 13.26 0 AU 0.9563
751.4 13.31 0.1857 B1U 0.9563
748.5 13.36 0.1507 B3U 0.9563
748.2 13.36 0 B3G 0.9563
745.4 13.42 0 B3G 0.9563
744.9 13.43 0 B1G 0.9563
740.3 13.51 0 B2G 0.9563
738.6 13.54 0 B1G 0.9563
736.3 13.58 0 B2G 0.9563
734.8 13.61 0 AG 0.9563
733.3 13.64 0 AU 0.9563
732.9 13.64 0 B2G 0.9563
726.9 13.76 0 AU 0.9563
726.5 13.76 1.322 B3U 0.9563
725.8 13.78 0.1029 B3U 0.9563
725.5 13.78 0.7546 B2U 0.9563
721.6 13.86 0 AU 0.9563
721.4 13.86 3.716 B1U 0.9563
720.2 13.88 0 B3G 0.9563
714.3 14 0 B1G 0.9563
713.5 14.02 0 B2G 0.9563
711 14.06 0 AG 0.9563
709.2 14.1 0.5572 B3U 0.9563
709 14.1 0 B2G 0.9563
706.8 14.15 0.3522 B2U 0.9563
703.4 14.22 0 B1G 0.9563
701.9 14.25 0 B2G 0.9563
699.9 14.29 0 B3G 0.9563
698.8 14.31 0 AU 0.9563
691.3 14.46 0 B2G 0.9563
690.9 14.47 0.0285 B1U 0.9563
686.1 14.57 0 B3G 0.9563
679.7 14.71 0 B1G 0.9563
679.3 14.72 0 AU 0.9563
678.8 14.73 0.4283 B3U 0.9563
677.6 14.76 0 AG 0.9563
673.5 14.85 0 B3G 0.9563
671.5 14.89 0.196 B2U 0.9563
670.9 14.91 2.099 B3U 0.9563
670.8 14.91 1.681 B1U 0.9563
669.5 14.94 0 AU 0.9563
663.7 15.07 0 B2G 0.9563
662.7 15.09 0.0003 B3U 0.9563
661.4 15.12 0 B1G 0.9563
660.1 15.15 0.1191 B1U 0.9563
658.6 15.18 3.805 B3U 0.9563
655.7 15.25 0 AG 0.9563
650 15.38 0 AU 0.9563
645.8 15.48 0.2764 B2U 0.9563
642.5 15.56 0.1042 B1U 0.9563
640.1 15.62 0 B3G 0.9563
639.3 15.64 0 AG 0.9563
638.1 15.67 0 B1G 0.9563
636.2 15.72 0 AG 0.9563
633.1 15.79 0 B2G 0.9563
628.1 15.92 0 B3G 0.9563
627.1 15.95 1.142 B1U 0.9563
623 16.05 0.4619 B2U 0.9563
621 16.1 1.153 B1U 0.9563
620.2 16.12 0.209 B2U 0.9563
614.3 16.28 0 B2G 0.9563
612.5 16.33 0 AU 0.9563
609.3 16.41 0 B1G 0.9563
607.5 16.46 4.045 B2U 0.9563
601.7 16.62 0.0027 B3U 0.9563
599.9 16.67 10.34 B3U 0.9563
594.4 16.82 0 AG 0.9563
591.4 16.91 0 B2G 0.9563
589.7 16.96 0 B1G 0.9563
589.3 16.97 0.1936 B2U 0.9563
589 16.98 0 AU 0.9563
588.9 16.98 0 B2G 0.9563
587.3 17.03 0 B1G 0.9563
586.7 17.04 0 B3G 0.9563
583.6 17.14 0.0107 B1U 0.9563
580.2 17.24 0.1095 B3U 0.9563
580 17.24 0 B3G 0.9563
579.6 17.25 0 AU 0.9563
578.7 17.28 18.88 B3U 0.9563
572.8 17.46 0 B1G 0.9563
572.8 17.46 0.0954 B3U 0.9563
569.8 17.55 0 B3G 0.9563
569.1 17.57 0 AG 0.9563
567.8 17.61 0 B2G 0.9563
565.9 17.67 0 AU 0.9563
563.3 17.75 1.902 B1U 0.9563
561.8 17.8 10.08 B2U 0.9563
550.1 18.18 0 AU 0.9563
549.6 18.19 0 AG 0.9563
545.5 18.33 0 B2G 0.9563
544.6 18.36 0.0116 B1U 0.9563
543.9 18.39 0 B1G 0.9563
543.5 18.4 0 B3G 0.9563
541.6 18.46 0.4417 B2U 0.9563
532.9 18.77 0 AU 0.9563
531.8 18.8 0 B1G 0.9563
530.3 18.86 3.582 B3U 0.9563
529.1 18.9 0 AG 0.9563
524.8 19.05 0 AG 0.9563
522.7 19.13 0 B3G 0.9563
517.8 19.31 3.358 B1U 0.9563
516.5 19.36 0 B2G 0.9563
514.4 19.44 0.2858 B2U 0.9563
512.8 19.5 0 B3G 0.9563
490.6 20.38 2.635 B2U 0.9563
484 20.66 0.098 B1U 0.9563
474.8 21.06 0 B3G 0.9563
473 21.14 0 AG 0.9563
466.9 21.42 1.154 B3U 0.9563
459.1 21.78 0 AG 0.9563
458.1 21.83 0 AU 0.9563
454.9 21.98 1.069 B2U 0.9563
454.9 21.98 0 B3G 0.9563
447.5 22.35 0 AG 0.9563
445.4 22.45 0 B1G 0.9563
437.6 22.85 0 B2G 0.9563
435.4 22.97 0 B2G 0.9563
431.3 23.19 0 AU 0.9563
428.7 23.33 0.6085 B3U 0.9563
427.6 23.38 0 B2G 0.9563
427.1 23.42 0.1004 B1U 0.9563
426.7 23.43 3.18 B2U 0.9563
426.4 23.45 0 B1G 0.9563
425.2 23.52 0 B2G 0.9563
421.2 23.74 0 B2G 0.9563
420.8 23.77 0 AU 0.9563
418.7 23.89 0.0149 B1U 0.9563
414.3 24.14 0.4531 B3U 0.9563
410.1 24.38 0 AU 0.9563
402.1 24.87 0 B3G 0.9563
399.2 25.05 0 B1G 0.9563
390.3 25.62 0.071 B3U 0.9563
389.2 25.69 0 AG 0.9563
381 26.24 0 B3G 0.9563
379.8 26.33 0 B1G 0.9563
377.7 26.48 0 B2G 0.9563
364.2 27.45 1.23 B3U 0.9563
362.1 27.61 0 B1G 0.9563
360.5 27.74 0.0018 B1U 0.9563
359.2 27.84 0 B2G 0.9563
357.3 27.98 0 AU 0.9563
356 28.09 3.746 B1U 0.9563
354 28.25 2.255 B2U 0.9563
353.5 28.29 3.947 B3U 0.9563
352.6 28.36 0.4905 B2U 0.9563
345.7 28.92 0.2149 B3U 0.9563
344.5 29.02 0 AU 0.9563
331.9 30.13 0 B3G 0.9563
329.6 30.34 2.422 B1U 0.9563
328.4 30.45 0 AU 0.9563
326.7 30.61 0 B1G 0.9563
314.2 31.82 1.375 B2U 0.9563
314.2 31.83 0 B2G 0.9563
313.8 31.87 0.5818 B3U 0.9563
298.4 33.51 0 B1G 0.9563
294.4 33.97 0 B3G 0.9563
293.5 34.07 0 AG 0.9563
289.8 34.5 1.072 B3U 0.9563
283.7 35.25 0 AU 0.9563
281.4 35.54 0 B2G 0.9563
279.1 35.82 0 B1G 0.9563
278.8 35.86 0 B2G 0.9563
265.6 37.65 0 AG 0.9563
261.1 38.29 0 AU 0.9563
255.9 39.08 0 B1G 0.9563
246.1 40.63 0.0024 B3U 0.9563
241.5 41.41 0 B1G 0.9563
240.8 41.53 0 B2G 0.9563
239.1 41.82 0.1213 B1U 0.9563
232.1 43.08 0 B3G 0.9563
227.3 44 0.0023 B2U 0.9563
215.6 46.38 5.011 B3U 0.9563
207.9 48.1 0 AU 0.9563
207.4 48.22 0.0846 B3U 0.9563
203.3 49.2 0 AU 0.9563
202.2 49.46 0 B1G 0.9563
198.9 50.28 0 B2G 0.9563
197.5 50.62 0 AG 0.9563
174.8 57.21 6.513 B2U 0.9563
173.6 57.59 0 AU 0.9563
170.1 58.79 0.1087 B3U 0.9563
159.5 62.71 5.891 B1U 0.9563
158.1 63.24 0 B3G 0.9563
154.2 64.85 0 AG 0.9563
152.8 65.46 0 B2G 0.9563
150.4 66.5 0 B2G 0.9563
149.1 67.07 0 B1G 0.9563
146.4 68.29 0.0011 B3U 0.9563
137.5 72.71 0 B1G 0.9563
122.9 81.35 0 B2G 0.9563
118.8 84.18 0.1654 B3U 0.9563
113.9 87.81 0 B1G 0.9563
97.41 102.7 2.874 B3U 0.9563
95.93 104.2 0 AU 0.9563
85.65 116.8 0 AU 0.9563
79.74 125.4 0 B2G 0.9563
78.71 127.1 0.3186 B3U 0.9563
65.89 151.8 0 B1G 0.9563
54.25 184.3 0 B2G 0.9563
52.66 189.9 0 AU 0.9563
48.29 207.1 0 B1G 0.9563
46.07 217.1 0.0129 B3U 0.9563
29.03 344.5 0 B2G 0.9563
28.98 345 0 B1G 0.9563
22.69 440.6 0.9769 B3U 0.9563
13.49 741.4 0 AU 0.9563
12.27 815.3 0.0018 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)