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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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140588 52724763 1 ON2C20H20 AB2C20D20 19.24 4.03 -9.21 -0.77 1
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140589 52726271 1 ON2C19H27 AB2C19D27 -15.15 6.94 0.0 0.0 0
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140590 52726657 1 ClN2O4C21H29 AB2C4D21E29 -129.83 5.96 -8.93 -0.57 1
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140591 52726682 1 Cl2N2O2C18H23 A2B2C2D18E23 -37.58 3.43 0.0 0.0 0
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140592 52726716 2 NOC11H14 ABC11D14 -37.44 5.37 -8.59 0.21 0
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140593 52726959 1 OSF2N4H16C17 ABC2D4E16F17 -18.49 5.76 -8.64 -0.71 0
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140594 52726960 1 OSF2N4H16C17 ABC2D4E16F17 -18.23 6.59 -8.64 -0.66 0
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140595 52727531 1 SCl2O3N4H12C15 AB2C3D4E12F15 0.43 1.88 -9.71 -1.68 0
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140596 52728190 1 NSO2C19H25 ABC2D19E25 -64.28 8.39 -8.26 0.14 0
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140597 52728670 1 SN2O4C18H22 AB2C4D18E22 -119.75 6.85 -8.85 -0.41 1
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140598 52728856 1 N2O3C22H31 A2B3C22D31 -81.57 4.9 0.0 0.0 0
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140599 52728857 1 N2O3C22H30 A2B3C22D30 -95.88 6.54 -8.63 -0.69 1
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140600 52728858 1 O2N3C21H34 A2B3C21D34 -57.85 7.17 0.0 0.0 0
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140601 52728859 1 O2N3C21H33 A2B3C21D33 -83.61 3.36 -8.53 0.4 1
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140602 52728860 1 FN2O2C18H28 AB2C2D18E28 -110.42 3.69 0.0 0.0 0
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140603 52728861 1 FN2O2C18H27 AB2C2D18E27 -130.09 4.77 -8.98 -0.02 0
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140604 52728911 1 BrN3O3C18H26 AB3C3D18E26 -119.11 7.77 -8.81 -0.19 0
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140605 52729389 1 ClNSO3C20H24 ABCD3E20F24 -100.72 1.86 -8.29 -0.45 0
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140606 52729430 1 BrN2O3C17H17 AB2C3D17E17 -85.64 4.14 -9.07 -0.68 0
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140607 52729436 1 NO3H19C21 AB3C19D21 -55.45 4.75 -8.77 -0.63 0
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140608 52729437 1 ClNSO2C17H18 ABCD2E17F18 -59.81 4.48 -8.86 -0.74 0
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140609 52729671 1 N2S2O3H16C17 A2B2C3D16E17 -48.8 2.98 -8.72 -1.26 0
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140610 52729672 1 OSN2C20H28 ABC2D20E28 -33.73 2.99 -9.09 -0.29 0
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140611 52729950 1 ON2C20H26 AB2C20D26 -28.44 4.31 -8.34 -0.26 0
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140612 52729951 1 ON4C20H20 AB4C20D20 49.39 4.76 -8.4 -0.84 0