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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182409 76886949 1 ON4C15H24 AB4C15D24 -3.29 3.58 -7.9 0.08 1
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182410 76887073 1 O2N6C10H15 A2B6C10D15 -6.47 1.75 0.0 0.0 0
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182411 76887114 1 FN2O3C13H17 AB2C3D13E17 -169.8 6.31 -9.68 -1.16 0
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182412 76887293 1 N2O3C14H18 A2B3C14D18 -115.28 2.09 -8.67 0.26 0
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182413 76887294 1 SN3O3C14H23 AB3C3D14E23 -134.34 6.08 -8.63 -0.1 0
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182414 76887295 1 O3N4C13H16 A3B4C13D16 -15.66 5.73 -10.13 -1.77 0
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182415 76887403 1 OSN2C13H22 ABC2D13E22 -54.9 2.83 -9.02 0.0 0
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182416 76887456 1 OS2N3C14H17 AB2C3D14E17 9.03 2.98 -8.85 -0.88 0
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182417 76887489 1 ON2S2C16H24 AB2C2D16E24 -43.17 2.6 -8.59 -0.31 0
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182418 76887547 1 BrOSN3C12H14 ABCD3E12F14 2.82 3.87 -9.17 -1.1 0
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182419 76887555 1 SO2N3C14H25 AB2C3D14E25 -89.74 4.88 -9.08 0.31 0
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182420 76887671 1 N2O2C17H28 A2B2C17D28 -112.67 3.04 -9.06 -0.1 0
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182421 76887672 1 ON5C15H27 AB5C15D27 -41.1 8.42 -9.57 0.36 0
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182422 76887673 1 OSN3C13H25 ABC3D13E25 -45.16 3.58 -8.9 0.49 0
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182423 76887674 1 F2N2S2O3C12H16 A2B2C2D3E12F16 -204.68 2.73 -8.75 -0.91 0
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182424 76887679 1 SF2N2O3C13H18 AB2C2D3E13F18 -210.35 6.62 -8.4 -0.22 0
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182425 76887873 1 OSN3C14H23 ABC3D14E23 -28.04 4.72 -8.54 0.19 0
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182426 76888075 1 SO2N3C15H25 AB2C3D15E25 -80.48 3.66 -7.91 0.17 0
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182427 76888182 1 Cl2O2N6H20C23 A2B2C6D20E23 59.05 8.68 -8.96 -1.74 0
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182428 76888286 1 ClO2N5C12H12 AB2C5D12E12 8.09 13.15 -9.18 -1.4 1
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182429 76888582 1 N4O4C20H27 A4B4C20D27 -137.4 4.0 0.0 0.0 0
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182430 76888583 1 FO3N4C21H23 AB3C4D21E23 -99.86 6.54 -8.98 -0.59 0
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182431 76888584 1 O3N5C16H27 A3B5C16D27 -98.7 7.53 -9.49 -0.02 0
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182432 76888647 1 ON4C19H30 AB4C19D30 -31.51 6.51 -8.45 0.38 0
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182433 76888703 1 SN3O3H17C19 AB3C3D17E19 -50.5 6.3 -8.49 -1.18 0
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182434 76888837 1 SO3N6C23H24 AB3C6D23E24 43.96 5.41 -8.94 -1.85 0
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182435 76888838 1 SO2N5C28H33 AB2C5D28E33 8.4 3.29 -8.66 -0.23 0
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182436 76888920 1 SN3O3C22H31 AB3C3D22E31 -131.1 8.04 -8.68 -0.38 0
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182437 76888940 1 N2O4C25H30 A2B4C25D30 -102.35 5.1 -8.39 -1.53 0
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182438 76889164 1 OS2N4C20H22 AB2C4D20E22 23.36 4.95 -8.26 -0.18 0
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182439 76889640 3 FON2C8H9 ABC2D8E9 -199.75 7.84 -8.62 -0.88 0
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182440 76889890 1 BrN3O4H8C12 AB3C4D8E12 6.43 6.81 -10.01 -2.23 0
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182441 76890521 1 FOCl2N2H7C14 ABC2D2E7F14 -3.69 5.93 -9.3 -2.26 0
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182442 76890522 1 ClON2C17H21 ABC2D17E21 -50.88 6.43 -9.29 -0.13 0
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182443 76890591 1 N2O4H12C13 A2B4C12D13 -67.26 8.04 -9.53 -2.75 0
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182444 76890842 1 ON5C15H21 AB5C15D21 77.87 5.04 -8.31 -1.16 0
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182445 76890843 1 ON5C14H23 AB5C14D23 62.71 3.85 -8.52 -1.63 0
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182446 76890965 1 BrN2O2C14H15 AB2C2D14E15 -0.42 7.04 -9.61 -2.86 0
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182447 76890966 1 BrON2C14H17 ABC2D14E17 -27.04 3.81 -9.78 -0.73 0
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182448 76890967 1 BrON2C14H15 ABC2D14E15 20.95 7.2 -9.14 -2.03 0
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182449 76890968 1 BrN2O2H11C15 AB2C2D11E15 22.37 7.36 -9.23 -2.16 0
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182450 76890969 1 BrOCl2N2H7C14 ABC2D2E7F14 44.98 4.24 -9.49 -2.4 0
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182451 76890970 1 BrON2C12H13 ABC2D12E13 21.09 7.1 -9.19 -2.06 0
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182452 76890971 1 OBr2N2H8C14 AB2C2D8E14 65.74 6.28 -9.31 -2.2 0
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182453 76890972 1 BrIN2O2H8C15 ABC2D2E8F15 70.99 5.78 -9.69 -2.94 0
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182454 76890973 1 BrN2O2H4F5C11 AB2C2D4E5F11 -267.25 3.61 -9.48 -1.54 0
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182455 76890974 1 BrSN2O2H7C13 ABC2D2E7F13 58.73 7.44 -9.61 -2.86 0
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182456 76890975 1 BrON2H13C16 ABC2D13E16 42.55 6.8 -9.22 -2.11 0
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182457 76890976 1 BrON2C13H15 ABC2D13E15 8.03 7.12 -9.14 -2.04 0
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182458 76890977 1 BrOF2N2H7C14 ABC2D2E7F14 -30.68 5.52 -9.36 -2.29 0