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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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13780 398059 1 PO4N5C9H14 AB4C5D9E14 -163.21 3.71 -8.86 -0.28 0
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13781 398098 1 OCl2N2C20H29 AB2C2D20E29 -46.98 4.44 0.0 0.0 1
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13782 398148 1 O2N5C11H17 A2B5C11D17 -15.84 3.94 -8.63 -0.68 0
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13783 398169 1 SN2O3H16C18 AB2C3D16E18 -27.51 4.86 -9.22 -1.16 0
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13784 398176 1 N3C21H22 A3B21C22 120.02 1.25 0.0 0.0 1
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13785 398188 1 O2S2N3H23C27 A2B2C3D23E27 103.98 8.18 -8.13 -1.93 0
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13786 398190 1 Cl2N2O6H12C15 A2B2C6D12E15 -52.92 2.72 -9.66 -1.56 0
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13787 398192 1 F6O6C27H28 A6B6C27D28 -533.09 4.52 -9.46 -1.14 0
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13788 398285 1 OSN3H17C21 ABC3D17E21 56.82 2.64 -8.4 -0.9 0
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13789 398292 1 O3N4H16C17 A3B4C16D17 -37.7 3.58 -8.5 -0.77 0
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13790 398299 1 O2F3N3H12C16 A2B3C3D12E16 -163.17 4.63 -8.89 -1.33 0
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13791 398300 1 O2N3H13C15 A2B3C13D15 -2.36 3.43 -8.74 -0.7 0
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13792 398305 1 N3O3C14H17 A3B3C14D17 -61.89 3.73 -8.75 -0.07 0
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13793 398306 1 O2N3H13C15 A2B3C13D15 -15.32 6.0 -8.34 -0.7 0
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13794 398307 1 O3N5C18H19 A3B5C18D19 -45.04 4.56 -8.4 -0.63 0
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13795 398332 1 N2O2C17H18 A2B2C17D18 -51.1 4.56 -8.51 -0.5 0
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13796 398384 1 SN2O3C23H32 AB2C3D23E32 -151.57 4.49 -8.67 -0.43 0
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13797 398386 1 NOSC17H19 ABCD17E19 -5.72 3.03 -8.58 -0.36 0
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13798 398387 1 NOSC15H17 ABCD15E17 -20.93 5.18 -8.8 -0.62 0
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13799 398399 1 N2O5C15H26 A2B5C15D26 -261.76 4.82 -9.47 0.29 0
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13800 398400 1 N2O5C14H24 A2B5C14D24 -255.49 5.8 -9.82 0.44 0
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13801 398404 2 NO3C9H15 AB3C9D15 -287.92 2.42 -9.11 -1.24 0
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13802 398467 1 SN2O3C21H22 AB2C3D21E22 -67.89 7.38 -9.17 -0.87 0
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13803 398490 2 S2N4H5C7 A2B4C5D7 223.23 8.12 -9.38 -2.36 0
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13804 398509 2 ON2S3H7C11 AB2C3D7E11 59.51 0.63 -8.56 -0.97 0
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13805 398517 1 SO3N4C21H22 AB3C4D21E22 -20.11 13.37 -7.76 -1.23 0
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13806 398518 1 S2O5C14H22 A2B5C14D22 -225.31 2.92 -8.84 -1.63 0
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13807 398519 1 SO3C15H20 AB3C15D20 -133.56 4.54 -9.0 -0.82 0
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13808 398527 1 BrN3O3C10H10 AB3C3D10E10 -112.69 5.96 -9.61 -1.31 0
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13809 398528 1 ClNO3C11H12 ABC3D11E12 -120.25 3.99 -9.32 -0.72 0
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13810 398540 1 SO3N4C15H22 AB3C4D15E22 -113.18 2.28 -8.61 -0.55 0
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13811 398546 1 FN4O6C9H11 AB4C6D9E11 -187.39 5.16 -10.77 -1.67 0
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13812 398593 1 BrN3C12H28 AB3C12D28 -30.97 1.09 -8.65 1.25 0
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13813 398662 1 ClON3C23H32 ABC3D23E32 -59.41 7.57 -8.44 0.06 0
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13814 398698 1 NSO7C27H29 ABC7D27E29 -196.88 3.07 -8.44 -1.09 0
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13815 398742 1 N3C8H19 A3B8C19 -1.66 3.78 -8.41 2.81 0
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13816 398747 2 NO2S2C11H12 AB2C2D11E12 -118.37 6.64 -8.55 -0.99 0
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13817 398773 1 NO3C13H15 AB3C13D15 -111.11 4.54 -9.14 -0.32 0
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13818 398774 1 NO4C11H11 AB4C11D11 -130.47 4.92 -9.29 -0.23 0
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13819 398826 1 ClN2O5C17H23 AB2C5D17E23 -201.23 2.61 -8.93 -1.37 0
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13820 398853 1 NO2C17H23 AB2C17D23 -52.4 2.04 -7.96 0.26 0
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13821 398903 1 SCl2O2N7H11C13 AB2C2D7E11F13 86.55 6.69 -8.65 -1.58 0
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13822 398921 1 SBr2O3H6C7 AB2C3D6E7 -85.86 3.63 -9.91 -1.27 0
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13823 398923 1 OSBr2Cl2H2C7 ABC2D2E2F7 5.69 3.92 -10.02 -1.63 0
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13824 398959 1 O3N6C22H26 A3B6C22D26 -21.49 4.67 -8.02 -0.84 0
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13825 398983 1 O15C28H36 A15B28C36 -607.54 8.87 -8.91 -1.12 0
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13826 399002 1 ClON5C13H14 ABC5D13E14 -1.97 7.42 -9.32 -1.06 0
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13827 399047 1 SN3O3H9C11 AB3C3D9E11 -1.81 11.36 -8.72 -1.2 0
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13828 399064 1 ClN2O3H15C22 AB2C3D15E22 11.56 2.23 -9.26 -1.54 0
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13829 399180 1 O10C37H58 A10B37C58 -464.06 5.04 -9.64 0.25 0