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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148777 53788446 1 OC22H34 AB22C34 -33.06 0.67 -8.98 1.16 0
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148778 53788447 1 OC22H34 AB22C34 -32.98 0.72 -8.99 1.16 0
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148779 53788448 2 NC11H15 AB11C15 24.35 1.26 -8.48 0.39 0
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148780 53788449 1 NH9C11 AB9C11 85.49 2.23 -8.86 -1.39 0
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148781 53788450 1 NOC6H11 ABC6D11 -29.1 4.14 -9.51 1.04 0
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148782 53788451 1 C7O8H12 A7B8C12 -348.48 2.75 -10.42 -1.2 0
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148783 53788452 1 N3O3C37H43 A3B3C37D43 -38.95 6.33 -8.31 -0.66 0
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148784 53788453 1 SF2O2H22C23 AB2C2D22E23 -101.83 2.0 -8.7 -0.36 0
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148785 53788454 1 OSN5H13C16 ABC5D13E16 63.87 4.12 -9.21 -0.8 0
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148786 53788455 1 S2N3O4C21H23 A2B3C4D21E23 -90.9 3.42 -9.3 -1.11 0
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148787 53788456 1 O7C16H20 A7B16C20 -251.96 4.34 -8.86 -0.46 0
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148788 53788457 1 OSN2C18H24 ABC2D18E24 -36.2 1.82 -8.61 -0.5 0
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148789 53788458 1 N2O3H20C21 A2B3C20D21 -54.76 4.52 -9.37 -1.11 0
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148790 53788459 1 N2C11H18 A2B11C18 -5.2 4.86 -8.5 1.13 0
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148791 53788460 1 O2N5C17H17 A2B5C17D17 16.25 6.21 -8.42 -0.68 0
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148792 53788461 1 SN2O6H28C30 AB2C6D28E30 -168.85 3.82 -9.48 -1.19 0
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148793 53788462 1 N2O2S2F3C12H19 A2B2C2D3E12F19 -236.08 1.06 -8.61 -0.3 0
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148794 53788463 1 NSSiO3C15H25 ABCD3E15F25 -173.54 4.26 -8.99 -0.1 0
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148795 53788464 1 O4F6H16C21 A4B6C16D21 -456.33 5.53 -9.93 -0.84 0
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148796 53788465 1 ON2C18H36 AB2C18D36 -106.17 3.97 -9.52 1.26 0
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148797 53788466 1 N2O3C12H20 A2B3C12D20 -157.82 4.13 -9.82 -0.32 0
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148798 53788467 1 NOF4C25H31 ABC4D25E31 -233.17 3.73 -8.87 -0.6 0
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148799 53788468 1 F2N4O9H32C34 A2B4C9D32E34 -289.8 9.94 -8.05 -0.7 0
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148800 53788469 1 Cl2N3O4C35H37 A2B3C4D35E37 -96.0 1.49 -8.49 -0.96 0
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148801 53788470 1 SCl2N2O5C17H18 AB2C2D5E17F18 -180.17 11.84 -9.82 -2.06 0
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148802 53788471 1 N2O7H16C17 A2B7C16D17 -209.17 7.85 -8.67 -1.72 0
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148803 53788472 2 NOC6H6 ABC6D6 -7.06 3.5 -8.54 -0.76 0
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148804 53788473 1 S2N4O5C21H24 A2B4C5D21E24 -150.93 5.81 -8.36 -0.96 0
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148805 53788474 1 N3O5C21H35 A3B5C21D35 -239.05 5.35 -9.74 -0.72 0
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148806 53788475 1 N4O6C43H62 A4B6C43D62 -292.85 8.57 -8.67 -0.3 1
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148807 53788476 1 N2O6C23H23 A2B6C23D23 -165.59 10.66 0.0 0.0 0
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148808 53788477 1 S2N5O5C21H29 A2B5C5D21E29 -136.36 7.28 -9.12 -0.83 0
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148809 53788478 1 N5C13H13 A5B13C13 86.5 3.73 -8.94 -0.89 0
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148810 53788479 1 NO2F5C28H28 AB2C5D28E28 -311.28 2.39 -9.97 -0.78 1
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148811 53788480 1 O2S2N3C20H26 A2B2C3D20E26 -9.88 2.79 0.0 0.0 0
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148812 53788481 1 NSCl2C20H25 ABC2D20E25 6.84 4.59 -8.55 -0.56 0
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148813 53788482 1 FNCl2O5H22C25 ABC2D5E22F25 -194.97 6.03 -8.55 -0.94 0
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148814 53788483 2 OC11H17 AB11C17 -7.92 4.73 -8.07 -0.02 0
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148815 53788484 1 NOSCl2F3H10C17 ABCD2E3F10G17 -152.72 3.41 -8.73 -0.86 0
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148816 53788485 1 SCl3N4O4C34H37 AB3C4D4E34F37 -107.19 6.68 -8.75 -1.36 0
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148817 53788486 1 ClS2O3N4H19C20 AB2C3D4E19F20 -34.48 6.04 -9.21 -1.59 0
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148818 53788487 1 IO2C5H7 AB2C5D7 -60.5 2.39 -9.95 -1.33 0
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148819 53788488 1 OSN3C23H25 ABC3D23E25 19.54 3.19 -8.91 -0.86 0
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148820 53788489 1 NO4C14H23 AB4C14D23 -191.97 3.9 -9.94 -0.58 0
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148821 53788490 1 C7H12 A7B12 -9.95 0.89 -9.63 1.48 0
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148822 53788491 1 NO3C23H29 AB3C23D29 -101.55 2.51 -8.83 0.14 0
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148823 53788492 1 OCl3C9H11 AB3C9D11 -54.47 4.23 -9.96 -0.26 0
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148824 53788493 1 NSO3C14H19 ABC3D14E19 -116.01 4.64 -9.11 -0.35 0
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148825 53788494 1 N3O8C45H79 A3B8C45D79 -455.41 5.05 -9.79 -0.1 0
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148826 53788495 1 SO2N3C16H21 AB2C3D16E21 -46.47 5.16 -9.32 -0.2 0