ELECTRONIC SUPPLEMENTARY MATERIAL for the article: =================================================== Millimeter- and submillimeter-wave spectroscopy of HBS and DBS in vibrationally excited states by L. Bizzocchi and C. Degli Esposti TABLE S1 Experimental transition frequencies and least squares residuals (MHz) of H(11)B(32)S in the ground vibrational state. ------------------------------------------------------ J' <-- J observed o - c ------------------------------------------------------ 2 1 76331.344 0.005 3 2 114495.703 0.007 4 3 152658.487 0.008 5 4 190819.171 0.007 7 6 267132.146 0.009 8 7 305283.377 0.001 9 8 343430.421 0.004 10 9 381572.727 -0.008 11 10 419709.800 -0.007 12 11 457841.100 -0.006 13 12 495966.111 0.003 14 13 534084.286 -0.003 15 14 572195.120 -0.004 17 16 648392.650 -0.005 18 17 686478.303 0.001 19 18 724554.512 0.008 ------------------------------------------------------- TABLE S2 Experimental transition frequencies and least squares residuals (MHz) of H(11)B(32)S in the 01(1)0 vibrationally excited state. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 2 1 1- 76332.489 -0.001 3 2 1- 114497.408 -0.007 4 3 1- 152660.761 0.005 5 4 1- 190821.991 0.007 8 7 1- 305287.714 0.003 9 8 1- 343435.210 0.003 10 9 1- 381577.954 0.004 11 10 1- 419715.407 -0.005 13 12 1- 495972.378 -0.001 14 13 1- 534090.824 -0.004 15 14 1- 572201.879 -0.004 17 16 1- 648399.697 -0.002 18 17 1- 686485.402 -0.001 19 18 1- 724561.607 0.006 2 1 1+ 76518.398 0.005 3 2 1+ 114776.271 0.015 4 3 1+ 153032.526 0.006 5 4 1+ 191286.660 0.009 8 7 1+ 306030.922 0.004 9 8 1+ 344271.188 0.001 10 9 1+ 382506.661 0.003 11 10 1+ 420736.795 -0.003 13 12 1+ 497178.943 -0.006 14 13 1+ 535389.889 -0.006 15 14 1+ 573593.371 -0.006 17 16 1+ 649975.806 -0.009 18 17 1+ 688153.706 0.000 19 18 1+ 726322.013 0.014 ------------------------------------------------------ TABLE S3 Experimental transition frequencies and least squares residuals (MHz) for the resonance system 00(0)1 -- 02(0)0 -- 02(2)0 of H(11)B(32)S. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 00(0)1 vibrational state ------------------------------------------------------ 2 1 0 75920.934 -0.001 3 2 0 113880.080 -0.004 4 3 0 151837.640 -0.012 8 7 0 303641.578 0.008 9 8 0 341583.329 0.004 10 9 0 379520.337 0.001 11 10 0 417452.076 0.000 13 12 0 493297.641 0.006 14 13 0 531210.395 -0.006 15 14 0 569115.779 -0.008 17 16 0 644902.315 0.000 18 17 0 682782.406 0.004 ------------------------------------------------------ 02(l)0 vibrational state ------------------------------------------------------ 2 1 0 76513.818 0.003 3 2 0 114769.063 0.005 4 3 0 153022.313 0.009 5 4 0 191272.901 0.015 8 7 0 306002.008 0.004 9 8 0 344235.263 -0.019 10 9 0 382462.574 0.001 11 10 0 420683.217 0.004 13 12 0 497101.883 -0.004 14 13 0 535298.594 -0.005 15 14 0 573486.014 0.000 17 16 0 649830.322 -0.002 18 17 0 687985.916 0.006 3 2 2- 114764.661 -0.005 4 3 2- 153017.050 -0.004 5 4 2- 191267.299 0.002 8 7 2- 305999.802 0.003 9 8 2- 344236.132 0.028 10 9 2- 382467.586 0.001 11 10 2- 420693.703 -0.002 13 12 2- 497127.714 -0.005 14 13 2- 535334.538 -0.002 15 14 2- 573533.852 -0.005 17 16 2- 649907.824 -0.007 18 17 2- 688081.425 0.008 3 2 2+ 114765.181 -0.008 4 3 2+ 153018.351 -0.008 5 4 2+ 191269.901 -0.006 8 7 2+ 306010.762 0.004 9 8 2+ 344251.760 0.004 10 9 2+ 382489.105 0.005 11 10 2+ 420722.384 0.002 13 12 2+ 497175.117 -0.009 14 13 2+ 535393.760 -0.009 15 14 2+ 573606.704 -0.005 17 16 2+ 650013.826 0.000 18 17 2+ 688207.179 0.009 ------------------------------------------------------ TABLE S4 Experimental transition frequencies and least squares residuals (MHz) of H(10)B(32)S in the ground vibrational state. ------------------------------------------------------ J' <-- J observed o - c ------------------------------------------------------ 2 1 80320.209 0.001 3 2 120478.872 0.001 4 3 160635.804 0.001 5 4 200790.429 0.000 7 6 281090.460 0.005 8 7 321234.719 0.017 9 8 361374.332 -0.003 10 9 401508.770 -0.009 11 10 441637.448 -0.008 13 12 521875.207 0.001 14 13 561983.123 -0.001 16 15 642174.164 -0.001 17 16 682256.135 0.000 18 17 722328.305 0.003 ------------------------------------------------------ TABLE S5 Experimental transition frequencies and least squares residuals (MHz) of H(10)B(32)S in the 01(1)0 vibrationally excited state. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 2 1 1- 80331.794 0.004 3 2 1- 120496.239 0.005 4 3 1- 160658.941 0.007 8 7 1- 321280.694 -0.001 9 8 1- 361425.968 -0.002 10 9 1- 401566.017 -0.001 11 10 1- 441700.259 0.002 12 11 1- 481828.104 -0.003 13 12 1- 521948.990 0.003 14 13 1- 562062.310 -0.006 16 15 1- 642263.995 -0.003 17 16 1- 682351.190 0.001 18 17 1- 722428.509 0.003 2 1 1+ 80535.211 0.005 3 2 1+ 120801.348 0.006 4 3 1+ 161065.723 0.005 8 7 1+ 322093.888 0.000 9 8 1+ 362340.664 0.001 10 9 1+ 402582.165 0.007 12 11 1+ 483046.953 -0.007 13 12 1+ 523269.089 -0.005 14 13 1+ 563483.598 -0.003 16 15 1+ 643887.384 -0.003 17 16 1+ 684075.494 0.002 18 17 1+ 724253.628 0.004 ------------------------------------------------------ TABLE S6 Experimental transition frequencies and least squares residuals (MHz) for the resonance system 00(0)1 -- 02(0)0 -- 02(2)0 of H(10)B(32)S. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 00(0)1 vibrational state ------------------------------------------------------ 2 1 0 79885.195 -0.001 3 2 0 119826.351 0.009 4 3 0 159765.774 0.030 8 7 0 319494.306 0.000 9 8 0 359416.280 0.000 10 9 0 399333.022 -0.003 12 11 0 479148.499 -0.008 13 12 0 519046.079 -0.003 14 13 0 558936.091 -0.014 16 15 0 638691.175 0.002 17 16 0 678555.068 0.010 ------------------------------------------------------ 02(l)0 vibrational state ------------------------------------------------------ 2 1 0 80534.061 -0.008 3 2 0 120799.205 -0.006 4 3 0 161062.084 0.000 8 7 0 322075.751 0.005 9 8 0 362315.928 0.001 10 9 0 402549.303 -0.003 12 11 0 482992.646 0.000 13 12 0 523201.106 -0.001 14 13 0 563399.766 0.001 16 15 0 643764.703 0.009 17 16 0 683929.479 -0.007 3 2 2- 120804.333 0.003 4 3 2- 161069.708 0.022 8 7 2- 322101.595 0.005 9 8 2- 362349.245 0.010 10 9 2- 402591.567 0.000 12 11 2- 483057.921 -0.010 13 12 2- 523280.785 0.003 14 13 2- 563495.953 -0.006 16 15 2- 643900.922 -0.006 17 16 2- 684089.548 0.008 3 2 2+ 120805.007 0.001 4 3 2+ 161071.393 0.018 8 7 2+ 322115.755 -0.009 9 8 2+ 362369.475 -0.001 10 9 2+ 402619.393 0.007 12 11 2+ 483106.084 -0.013 13 12 2+ 523342.038 -0.003 14 13 2+ 563572.458 -0.013 16 15 2+ 644015.046 -0.002 17 16 2+ 684226.333 0.015 ------------------------------------------------------ TABLE S7 Experimental transition frequencies and least squares residuals (MHz) of D(11)B(32)S in the ground vibrational state. ------------------------------------------------------ J' <-- J observed o - c ------------------------------------------------------ 3 2 95626.113 0.003 4 3 127499.878 0.003 5 4 159372.270 0.006 6 5 191242.926 -0.009 7 6 223111.551 0.009 8 7 254977.750 0.008 9 8 286841.194 0.004 10 9 318701.545 0.000 11 10 350558.464 0.004 12 11 382411.595 0.002 13 12 414260.595 -0.004 16 15 509779.410 -0.010 17 16 541608.475 -0.007 18 17 573431.688 -0.009 21 20 668862.832 0.001 22 21 700659.234 0.010 ------------------------------------------------------ TABLE S8 Experimental transition frequencies and least squares residuals (MHz) of D(11)B(32)S in the 01(1)0 vibrationally excited state. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 3 2 1- 95701.154 0.009 4 3 1- 127599.914 0.010 5 4 1- 159497.281 0.009 6 5 1- 191392.908 0.006 7 6 1- 223286.454 0.009 8 7 1- 255177.563 0.009 10 9 1- 318951.077 -0.001 11 10 1- 350832.797 -0.001 12 11 1- 382710.689 -0.004 13 12 1- 414584.411 -0.004 16 15 1- 510177.056 -0.011 17 16 1- 542030.616 -0.004 18 17 1- 573878.249 -0.013 21 20 1- 669382.246 0.004 22 21 1- 701202.771 0.010 3 2 1+ 95945.095 0.004 4 3 1+ 127925.153 0.006 5 4 1+ 159903.806 0.010 6 5 1+ 191880.703 0.016 7 6 1+ 223855.478 0.010 8 7 1+ 255827.790 0.003 10 9 1+ 319763.647 0.014 11 10 1+ 351726.463 0.006 12 11 1+ 383685.405 -0.008 13 12 1+ 415640.144 -0.004 16 15 1+ 511475.503 -0.015 17 16 1+ 543409.836 -0.020 18 17 1+ 575338.204 -0.012 21 20 1+ 671083.912 0.002 22 21 1+ 702984.858 0.019 ------------------------------------------------------ TABLE S9 Experimental transition frequencies and least squares residuals (MHz) for the resonance system 00(0)1 -- 02(0)0 -- 02(2)0 of D(11)B(32)S. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 00(0)1 vibrational state ------------------------------------------------------ 3 2 0 95465.110 0.001 4 3 0 127285.500 0.004 5 4 0 159104.765 0.010 10 9 0 318174.319 0.008 11 10 0 349980.930 0.013 12 11 0 381784.438 -0.003 13 12 0 413584.603 -0.002 16 15 0 508962.194 -0.006 17 16 0 540746.183 -0.009 18 17 0 572525.449 -0.016 21 20 0 667832.303 0.001 22 21 0 699590.055 0.012 ------------------------------------------------------ 02(l)0 vibrational state ------------------------------------------------------ 3 2 0 95733.849 -0.002 4 3 0 127643.147 0.006 5 4 0 159550.733 0.012 10 9 0 319048.067 0.013 11 10 0 350936.434 0.009 12 11 0 382820.110 0.005 13 12 0 414698.677 0.006 16 15 0 510299.436 -0.012 17 16 0 542153.307 -0.020 18 17 0 573999.962 -0.018 21 20 0 669492.389 -0.004 22 21 0 701305.978 0.023 3 2 2± 96013.363(a) -0.011 4 3 2± 128016.200(a) 0.004 5 4 2± 160017.621(a) 0.007 10 9 2- 319990.643 0.006 11 10 2- 351976.026 0.004 12 11 2- 383957.505 0.005 13 12 2- 415934.717 0.003 16 15 2- 511837.214 -0.011 17 16 2- 543793.821 -0.013 18 17 2- 575744.386 -0.017 21 20 2- 671556.324 0.005 22 21 2- 703479.190 0.013 10 9 2+ 319992.053 0.007 11 10 2+ 351977.874 0.006 12 11 2+ 383959.863 0.010 13 12 2+ 415937.652 0.007 16 15 2+ 511842.268 -0.009 17 16 2+ 543799.698 -0.004 18 17 2+ 575751.116 -0.012 21 20 2+ 671565.705 0.003 22 21 2+ 703489.417 0.004 ------------------------------------------------------ a) Average frequency of the e/f doublet. TABLE S10 Experimental transition frequencies and least squares residuals (MHz) of D(10)B(32)S in the ground vibrational state. ------------------------------------------------------ J' <-- J observed o - c ------------------------------------------------------ 3 2 99378.455 0.007 4 3 132502.880 0.008 5 4 165625.810 -0.006 6 5 198746.892 -0.019 7 6 231865.798 0.010 8 7 264982.085 0.009 9 8 298095.406 0.001 10 9 331205.412 0.006 11 10 364311.716 0.007 12 11 397413.946 0.002 13 12 430511.741 0.000 15 14 496692.537 -0.007 16 15 529774.798 -0.011 17 16 562851.150 -0.008 20 19 662041.002 -0.001 21 20 695089.996 0.010 ------------------------------------------------------ TABLE S11 Experimental transition frequencies and least squares residuals (MHz) of D(10)B(32)S in the 01(1)0 vibrationally excited state. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 3 2 1- 99473.472 0.003 4 3 1- 132629.555 0.011 5 4 1- 165784.145 0.023 7 6 1- 232087.282 -0.003 9 8 1- 298379.970 0.007 10 9 1- 331521.434 0.000 11 10 1- 364659.158 -0.002 12 11 1- 397792.769 0.001 13 12 1- 430921.875 -0.006 15 14 1- 497165.119 -0.010 16 15 1- 530278.514 -0.001 17 16 1- 563385.899 -0.010 20 19 1- 662668.398 0.001 21 20 1- 695748.090 0.009 3 2 1+ 99732.487 0.005 4 3 1+ 132974.884 0.009 5 4 1+ 166215.768 0.016 6 5 1+ 199454.761 0.026 7 6 1+ 232691.442 -0.002 9 8 1+ 299156.538 0.010 10 9 1+ 332384.147 0.002 11 10 1+ 365607.975 0.002 12 11 1+ 398827.625 -0.008 13 12 1+ 432042.743 -0.004 15 14 1+ 498457.807 -0.013 16 15 1+ 531657.007 -0.015 17 16 1+ 564850.149 -0.012 20 19 1+ 664389.415 -0.004 21 20 1+ 697554.544 0.022 ------------------------------------------------------ TABLE S12 Experimental transition frequencies and least squares residuals (MHz) for the resonance system 00(0)1 -- 02(0)0 -- 02(2)0 of D(10)B(32)S. ------------------------------------------------------ J' <-- J l observed o - c ------------------------------------------------------ 00(0)1 vibrational state ------------------------------------------------------ 3 2 0 99191.556 -0.010 4 3 0 132253.982 0.013 5 4 0 165315.132 0.003 9 8 0 297541.131 0.008 10 9 0 330591.418 0.004 11 10 0 363638.609 0.001 12 11 0 396682.391 -0.005 13 12 0 429722.479 0.006 16 15 0 528817.387 -0.010 17 16 0 561839.581 -0.015 20 19 0 660873.673 0.003 21 20 0 693873.207 0.007 ------------------------------------------------------ 02(l)0 vibrational state ------------------------------------------------------ 3 2 0 99546.735 0.001 4 3 0 132726.828 -0.011 5 4 0 165905.110 -0.001 9 8 0 298590.720 0.012 10 9 0 331752.961 0.013 11 10 0 364910.621 0.009 12 11 0 398063.249 0.006 13 12 0 431210.379 -0.008 15 14 0 497486.389 -0.006 16 15 0 530614.339 -0.013 17 16 0 563734.997 -0.010 20 19 0 663048.646 -0.004 21 20 0 696135.605 0.014 9 8 2- 299420.065 0.010 10 9 2- 332676.822 0.008 11 10 2- 365929.738 -0.001 12 11 2- 399178.448 -0.001 13 12 2- 432422.564 0.005 15 14 2- 498895.442 -0.007 16 15 2- 532123.453 -0.009 17 16 2- 565345.335 -0.008 20 19 2- 664970.369 0.010 9 8 2+ 299421.844 0.010 10 9 2+ 332679.247 0.008 11 10 2+ 365932.939 -0.003 12 11 2+ 399182.567 -0.002 13 12 2+ 432427.747 0.005 15 14 2+ 498903.206 -0.007 16 15 2+ 532132.736 -0.012 17 16 2+ 565356.302 -0.002 20 19 2+ 664987.223 -0.002 21 20 2+ 698182.985 0.008 ------------------------------------------------------