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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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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