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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
190869 78070542 1 OSiC6H7 ABC6D7 91.76 2.02 0.0 0.0 0
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190870 78070701 1 SN2O4H12C14 AB2C4D12E14 -125.39 4.84 -9.47 -1.29 0
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190871 78070702 1 S3C10H12 A3B10C12 44.56 0.76 -8.67 -1.09 0
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190872 78070703 2 O5N6C17H31 A5B6C17D31 -515.58 6.94 -9.35 -0.13 0
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190873 78070704 2 OC5H9 AB5C9 -98.61 2.56 -9.92 0.98 0
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190874 78070877 1 N6O7C37H42 A6B7C37D42 -249.0 5.35 -8.55 -0.07 0
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190876 78071683 1 NOH13C14 ABC13D14 28.93 4.04 -8.89 -0.51 0
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190877 78071899 1 BrN3O5C31H40 AB3C5D31E40 -201.5 11.23 -9.18 -0.9 0
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190878 78071920 1 O2N7C25H31 A2B7C25D31 2.45 3.05 -9.05 -0.73 0
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190879 78071927 1 F3O8N11C39H48 A3B8C11D39E48 -428.09 9.35 -9.03 -1.01 0
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190880 78071928 1 O6N11C37H47 A6B11C37D47 -173.81 9.36 -8.99 -1.0 0
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190881 78071929 1 N3O3C25H25 A3B3C25D25 -31.8 12.49 -8.92 -1.08 0
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190882 78071930 1 N3O3C27H29 A3B3C27D29 -37.6 6.22 -9.14 -1.09 0
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190883 78071931 1 SCl2O2N6H22C23 AB2C2D6E22F23 9.75 6.46 -8.89 -0.84 0
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190884 78071932 1 ClO2N3C23H24 AB2C3D23E24 -24.51 5.3 -8.98 -1.08 0
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190885 78071933 1 ClN3O3C23H24 AB3C3D23E24 -48.86 5.11 -8.9 -1.16 0
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190886 78071934 1 OSN3C22H25 ABC3D22E25 55.78 0.84 -8.55 -0.57 0
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190887 78071935 1 SO2N3C19H19 AB2C3D19E19 11.95 1.75 -9.07 -0.62 0
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190888 78071936 1 SO2N3H17C18 AB2C3D17E18 18.3 1.45 -9.04 -0.66 0
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190889 78071937 1 SO2N3C20H21 AB2C3D20E21 7.55 1.69 -8.98 -0.55 0
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190890 78071938 1 O2N6C25H30 A2B6C25D30 -14.51 1.86 -8.91 -0.72 0
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190891 78071939 1 FO3N4C19H19 AB3C4D19E19 -104.43 6.86 -8.67 -1.35 0
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190892 78072148 1 S2N3O3F6H23C25 A2B3C3D6E23F25 -361.17 3.66 -9.74 -1.41 0
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190893 78072149 1 SN2F3O3C21H23 AB2C3D3E21F23 -234.72 6.11 -9.83 -0.79 0
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190894 78072150 1 S2N3O4H25C30 A2B3C4D25E30 -7.09 10.52 -9.02 -1.66 0
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190895 78072318 1 ClN2O2F3H24C25 AB2C2D3E24F25 -161.76 6.28 -8.66 -0.94 0
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190896 78072319 1 N2O2F3H23C25 A2B2C3D23E25 -168.96 6.16 -8.78 -1.01 0
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190897 78072722 1 FO3N5H24C29 AB3C5D24E29 8.21 5.25 -8.55 -1.53 0
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190898 78072806 1 N4O14C57H68 A4B14C57D68 -444.94 6.73 -8.02 -0.65 0
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190899 78072950 1 ClO3N5C25H26 AB3C5D25E26 -63.76 6.9 -9.06 -1.04 0
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190900 78072951 1 O3N5C22H33 A3B5C22D33 -110.97 1.55 -8.67 -0.08 0
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190901 78072952 2 ClON3C12H13 ABC3D12E13 -49.5 2.95 -9.02 -1.04 0
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190902 78072953 1 ClO2N6C24H25 AB2C6D24E25 -15.59 5.83 -8.89 -0.97 0
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190903 78072954 2 N3O5C21H24 A3B5C21D24 -390.16 9.41 -8.71 -0.29 0
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190904 78072955 1 ClN6O9C36H41 AB6C9D36E41 -350.86 7.27 -8.78 -0.28 0
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190905 78072956 1 ClPN8O12C46H52 ABC8D12E46F52 -505.12 6.73 -8.93 -0.63 0
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190906 78073416 1 N3O3C16H17 A3B3C16D17 -43.96 2.5 -9.71 -0.26 0
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190907 78073887 1 N3O4C24H29 A3B4C24D29 -118.93 7.78 -8.6 -0.14 0
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190908 78074519 1 NOS2Cl3H8C12 ABC2D3E8F12 43.18 1.15 -8.8 -1.02 0
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190909 78074520 1 NOCl2S2H13C14 ABC2D2E13F14 32.7 1.56 -8.4 -0.95 0
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190910 78074594 1 N4O4H38C39 A4B4C38D39 -64.93 11.69 -8.62 -1.1 0
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190911 78074892 2 OSN2C12H18 ABC2D12E18 -57.68 6.02 -8.44 -0.57 0
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190912 78075013 1 ClFN2O4C25H26 ABC2D4E25F26 -192.51 3.1 -9.44 -0.32 1
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190913 78075871 1 BrNC25H31 ABC25D31 78.89 5.14 0.0 0.0 0
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190914 78075872 1 INC25H32 ABC25D32 87.87 19.86 -5.85 -1.3 0
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190915 78075938 1 N2O5C20H24 A2B5C20D24 -162.72 3.99 -8.12 -0.03 0
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190916 78076273 1 O23N48C111H196 A23B48C111D196 -969.22 9.71 -8.97 -0.27 0
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190917 78076274 1 N17O18C65H99 A17B18C65D99 -825.01 8.74 -8.85 -0.28 0
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190918 78076275 1 N14O15C49H68 A14B15C49D68 -478.38 16.25 -9.41 -2.0 1
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190919 78076327 1 NO4C21H38 AB4C21D38 -176.86 4.98 0.0 0.0 0