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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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183640 77047157 1 F2N2O2H8C9 A2B2C2D8E9 -120.26 4.84 -10.04 -0.88 0
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183641 77047158 2 FN2C7H7 AB2C7D7 -11.83 1.47 -9.13 -0.55 0
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183642 77047159 1 ClNO3C16H18 ABC3D16E18 -114.75 5.89 -9.75 -1.22 0
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183643 77047160 1 NSO3C15H19 ABC3D15E19 -105.43 9.3 -9.42 -1.14 0
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183644 77047161 1 N2O4C13H16 A2B4C13D16 -134.65 6.8 -10.3 -1.45 0
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183645 77047241 1 OF3N3C9H16 AB3C3D9E16 -179.68 1.96 -9.13 0.65 0
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183646 77047242 1 OF3N3C9H16 AB3C3D9E16 -176.43 4.48 -8.94 0.72 0
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183647 77047343 1 SO3N4H12C13 AB3C4D12E13 -22.65 4.4 -9.78 -1.59 0
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183648 77047686 1 O2N3C13H19 A2B3C13D19 -45.27 4.61 -9.7 -1.15 0
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183649 77048179 1 O2N4C11H20 A2B4C11D20 -35.54 7.38 -8.17 -0.38 0
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183650 77048413 1 FNO3C16H20 ABC3D16E20 -143.75 6.15 -9.64 -0.74 0
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183651 77048562 1 ClO2N3H10C12 AB2C3D10E12 21.27 2.78 -9.16 -0.88 0
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183652 77048673 1 SN3O4C13H13 AB3C4D13E13 -89.85 3.87 -9.49 -1.83 0
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183653 77048674 1 ClO2N3C14H18 AB2C3D14E18 -27.15 3.65 -9.36 -1.78 0
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183654 77049570 1 ClSN2O3C9H11 ABC2D3E9F11 -83.38 8.08 -10.16 -1.34 0
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183655 77049616 1 ClS2N3O3H10C11 AB2C3D3E10F11 -45.83 2.8 -8.95 -1.83 0
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183656 77049911 1 SO2N3C14H17 AB2C3D14E17 -39.22 3.51 -9.02 -0.36 0
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183657 77050989 1 OSN3C16H31 ABC3D16E31 -85.74 5.26 -9.0 0.03 0
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183658 77051408 1 ClNOC9H18 ABCD9E18 -59.37 3.25 -8.87 0.18 0
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183659 77051490 1 BrClOH12C14 ABCD12E14 1.98 1.81 -8.84 -0.82 0
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183660 77051491 1 ClOC11H19 ABC11D19 -68.32 3.28 -9.61 0.39 0
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183661 77052181 2 NC6H12 AB6C12 -13.98 0.72 -8.21 1.25 0
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183662 77052312 1 N2O2C11H14 A2B2C11D14 -66.59 2.91 -10.0 -0.93 0
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183663 77052379 1 ON3C15H21 AB3C15D21 0.98 5.83 -9.25 0.2 0
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183664 77052590 1 BrOC11H21 ABC11D21 -65.0 3.54 -9.64 0.3 0
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183665 77052591 1 BrOSN2C11H21 ABCD2E11F21 -72.13 1.98 -9.24 -0.12 1
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183666 77052592 1 BrN2O2C15H18 AB2C2D15E18 -33.8 3.37 0.0 0.0 2
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183667 77052593 1 BrN2O2C12H19 AB2C2D12E19 -90.06 6.97 -8.48 -0.14 0
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183668 77052707 1 BrOC10H19 ABC10D19 -62.16 2.06 -9.57 0.15 0
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183669 77052919 1 NC10H19 AB10C19 -19.89 2.43 -9.14 1.36 0
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183670 77053210 1 FNO3C15H16 ABC3D15E16 -152.88 3.3 -9.63 -0.69 0
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183671 77053242 1 N3O6C12H13 A3B6C12D13 -139.17 6.16 -10.66 -2.1 0
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183672 77053243 1 NSO3C14H17 ABC3D14E17 -115.97 10.04 -9.51 -1.19 0
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183673 77054084 1 N5C9H11 A5B9C11 91.85 5.56 -8.85 -0.6 0
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183674 77054122 1 ON5C9H19 AB5C9D19 -6.41 1.28 -8.3 1.07 0
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183675 77054446 1 N2O2C17H26 A2B2C17D26 -104.52 2.54 -9.04 -0.09 0
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183676 77054512 1 O2N3C16H25 A2B3C16D25 -63.49 2.62 -8.67 -0.1 0
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183677 77054547 1 NO3C10H17 AB3C10D17 -113.48 6.52 -10.0 0.46 0
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183678 77054804 1 FO2N4C12H15 AB2C4D12E15 -63.14 2.32 -9.28 -0.87 0
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183679 77054868 1 N2O2C11H14 A2B2C11D14 -28.79 2.7 -8.67 0.01 0
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183680 77054910 1 SN3O3C14H27 AB3C3D14E27 -165.66 4.93 -9.05 -0.01 0
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183681 77055098 1 ClBr2N2O2H9C13 AB2C2D2E9F13 17.58 1.95 -9.1 -0.97 0
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183682 77055099 1 Br2N2O3H12C14 A2B2C3D12E14 -37.26 6.66 -9.73 -1.07 0
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183683 77056152 1 O2N3C13H21 A2B3C13D21 -75.32 4.33 -8.92 -0.15 0
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183684 77056438 1 NCl2O2C15H19 AB2C2D15E19 -94.4 4.37 -9.59 -0.59 0
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183685 77056734 1 NO2C15H27 AB2C15D27 -131.42 3.04 -9.57 0.47 0
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183686 77057417 1 SN2O2C7H14 AB2C2D7E14 -67.27 7.7 -9.32 -0.2 0
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183687 77058368 1 N2O5C14H16 A2B5C14D16 -117.14 8.54 -10.38 -1.75 0
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183688 77058419 1 N3O3C13H17 A3B3C13D17 -33.45 7.35 -8.38 -1.51 0
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183689 77058420 1 NO4C12H15 AB4C12D15 -146.06 6.53 -9.52 -1.06 0