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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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390673 135000300 1 SN2O8C19H24 AB2C8D19E24 -212.0 6.51 -9.54 -1.63 0
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390674 135000310 1 C13H16 A13B16 30.82 0.72 -8.87 0.4 0
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390675 135000317 1 NSO2C12H13 ABC2D12E13 -28.78 1.32 -9.56 -1.24 1
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390676 135000330 1 OSeN2C22H25 ABC2D22E25 9.93 5.75 0.0 0.0 0
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390677 135000339 1 NSeO2H19C23 ABC2D19E23 38.67 1.19 -8.3 -0.87 0
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390678 135000341 1 ISe2N5C24H26 AB2C5D24E26 148.45 9.07 -7.93 -1.16 0
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390679 135000349 1 NC15H29 AB15C29 -56.57 1.41 -8.53 2.91 0
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390680 135000351 1 SO4C12H24 AB4C12D24 -196.68 4.88 -10.32 0.36 0
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390681 135000353 1 NO3C18H21 AB3C18D21 -77.39 3.32 -9.25 -0.34 0
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390682 135000354 1 NO4C14H23 AB4C14D23 -171.33 4.52 -9.5 0.33 0
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390683 135000359 1 LiOSeC9H9 ABCD9E9 -32.72 5.93 -7.85 -0.28 2
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390685 135000370 1 CoOF2P3C22H37 ABC2D3E22F37 -353.99 5.93 0.0 0.0 -1
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390686 135000371 1 CoN5O5C25H34 AB5C5D25E34 4.11 26.7 -10.13 -5.54 3
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390687 135000375 1 CoNF2P3C16H33 ABC2D3E16F33 -218.12 10.65 -8.97 -3.9 3
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390689 135000377 1 SN3O3C19H23 AB3C3D19E23 -78.71 8.85 -8.21 -0.74 0
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390690 135000383 2 BO2C11H17 AB2C11D17 -325.24 5.24 -8.82 0.57 0
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390691 135000384 1 BO4C23H31 AB4C23D31 -224.59 4.04 -9.26 -0.39 0
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390692 135000393 1 OC14H18 AB14C18 -12.4 2.18 -9.23 0.17 0
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390693 135000395 1 NPO7C17H18 ABC7D17E18 -183.02 5.35 -9.06 -1.56 0
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390694 135000396 1 SN2O3C14H18 AB2C3D14E18 17.92 8.92 -8.6 -1.2 0
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390695 135000397 1 NO3C25H25 AB3C25D25 -56.57 3.6 -8.26 -0.4 0
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390696 135000398 1 NO5C19H21 AB5C19D21 -143.96 6.65 -9.26 -0.39 0
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390697 135000399 2 O2H6C7 A2B6C7 -66.11 0.65 -9.5 -0.31 0
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390698 135000405 1 N2C25H36 A2B25C36 -2.81 2.18 -9.05 -0.17 0
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390699 135000406 1 N2C31H48 A2B31C48 -38.26 2.87 -8.96 0.16 0
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390700 135000412 1 N3O4H27C28 A3B4C27D28 -58.07 8.65 -9.62 -0.39 0
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390701 135000413 1 ON4C19H20 AB4C19D20 56.93 4.8 -9.82 -0.56 0
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390702 135000424 1 ClO5C24H27 AB5C24D27 -197.83 4.98 -9.42 -0.73 0
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390703 135000427 1 NO3C15H21 AB3C15D21 -48.82 5.1 -9.71 -0.71 0
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390704 135000434 1 ClNSO3C16H20 ABCD3E16F20 -141.64 1.83 -9.13 -0.2 0
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390705 135000436 1 ClNO3C15H18 ABC3D15E18 -55.46 5.24 -9.65 -0.74 0
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390707 135000481 1 SiSnC25H46 ABC25D46 -52.55 0.75 -8.53 0.61 0
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390708 135000482 1 SiSnC15H26 ABC15D26 -5.31 0.75 -8.19 0.37 0
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390709 135000484 1 SeN2O2H10C16 AB2C2D10E16 22.69 4.1 -8.51 -1.37 0
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390710 135000485 1 NSeBr2H9C15 ABC2D9E15 91.33 2.58 -9.11 -1.06 0
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390711 135000512 2 OC6H8 AB6C8 -65.03 1.62 -9.53 0.4 0
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390712 135000517 1 INO3C14H24 ABC3D14E24 -160.46 3.86 -9.64 -0.78 0
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390713 135000524 1 NO3C18H19 AB3C18D19 -86.16 5.33 -9.7 -0.11 0
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390714 135000525 1 NO3C18H19 AB3C18D19 -84.06 5.08 -9.6 0.04 0
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390715 135000527 1 BNO2C18H24 ABC2D18E24 -125.09 6.35 -9.36 0.26 0
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390716 135000532 1 NO4C21H23 AB4C21D23 -125.95 1.28 -8.27 0.25 0
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390717 135000533 1 NO4C16H21 AB4C16D21 -154.61 5.97 -8.52 0.03 0
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390718 135000539 1 OSiC20H34 ABC20D34 -73.01 1.98 -8.73 0.37 0
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390719 135000542 1 OSiC25H36 ABC25D36 -71.22 1.16 -9.15 0.28 0
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390720 135000548 1 OC13H20 AB13C20 -48.62 4.88 -9.8 0.02 0
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390721 135000549 1 OSiC20H38 ABC20D38 -94.03 3.13 -9.08 0.74 0
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390722 135000551 1 OC12H24 AB12C24 -94.4 3.0 -9.73 0.81 0
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390723 135000552 1 ClNO2C13H18 ABC2D13E18 -28.53 2.59 -9.7 -0.62 0
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390724 135000554 1 ClNO5H16C20 ABC5D16E20 76.11 33.1 -8.53 -3.05 0
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390725 135000567 1 NSO2C21H23 ABC2D21E23 -17.23 5.24 -9.34 -0.4 0