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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148877 53788547 2 NC2O2H4 AB2C2D4 -188.39 1.51 -10.52 -0.6 0
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148878 53788548 1 NPO5C19H40 ABC5D19E40 -349.03 1.12 -9.69 0.34 0
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148879 53788549 1 SN2O3C20H28 AB2C3D20E28 -94.41 5.61 -8.28 -0.26 0
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148880 53788550 1 NSO3C7H9 ABC3D7E9 -113.35 5.35 -9.82 -0.69 0
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148881 53788551 1 FON3H14C18 ABC3D14E18 15.36 4.97 -9.24 -0.94 0
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148882 53788552 1 N4O6H18C23 A4B6C18D23 68.92 3.39 -9.34 -2.86 0
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148883 53788553 1 SN3O5C23H45 AB3C5D23E45 -245.83 2.08 -9.55 0.14 0
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148884 53788554 1 N2S2O9C12H22 A2B2C9D12E22 -390.26 5.38 -9.69 -1.77 0
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148885 53788555 1 SN2O4C16H24 AB2C4D16E24 -152.74 7.55 -8.43 -0.08 -2
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148886 53788556 2 SN3O7H24C27 AB3C7D24E27 -268.04 28.02 -7.19 -2.9 0
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148887 53788557 1 S2N4O11H30C33 A2B4C11D30E33 -303.57 7.88 -8.08 -1.97 0
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148888 53788558 1 NSO4C21H31 ABC4D21E31 -195.68 3.5 -9.3 -0.18 0
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148889 53788559 1 NF3C18H20 AB3C18D20 -123.47 2.72 -8.52 -0.52 0
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148890 53788560 1 ClN3O3C22H26 AB3C3D22E26 -62.65 6.3 -8.62 -0.91 0
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148891 53788561 2 NO2C6H12 AB2C6D12 -242.74 1.81 -10.1 0.64 0
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148892 53788562 1 SN3O4C20H21 AB3C4D20E21 -95.88 4.16 -8.6 -0.74 0
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148893 53788563 1 O3H30C32 A3B30C32 -52.09 2.47 -8.43 -0.17 0
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148894 53788564 1 NO2C14H15 AB2C14D15 -23.97 3.18 -9.36 -0.2 0
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148895 53788565 1 ClFNSC9H9 ABCDE9F9 -12.17 2.34 -8.94 -0.66 0
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148896 53788566 1 SN2O3C16H16 AB2C3D16E16 -60.19 5.56 -8.89 -0.7 0
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148897 53788567 1 ClFNC17H17 ABCD17E17 -6.53 2.99 -9.38 -0.12 0
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148898 53788568 1 FO3C11H11 AB3C11D11 -135.38 3.31 -9.49 -0.33 0
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148899 53788569 2 N3C11H11 A3B11C11 158.57 5.69 -8.68 -0.75 0
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148900 53788570 2 N2H6C7 A2B6C7 107.37 1.72 -9.33 -0.94 0
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148901 53788571 1 N2O4C17H18 A2B4C17D18 -127.89 6.72 -9.86 -0.75 0
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148902 53788572 1 NO3C23H27 AB3C23D27 0.13 2.78 -8.68 -1.48 0
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148903 53788573 1 OS2C11H22 AB2C11D22 -64.54 1.34 -8.97 -0.64 0
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148904 53788574 1 S2N3O12H23C25 A2B3C12D23E25 -271.49 4.03 -10.75 -1.85 0
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148905 53788575 34 CH2 AB2 -142.35 0.17 -9.51 1.39 0
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148906 53788576 34 CH2 AB2 -140.35 0.15 -9.48 1.44 0
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148907 53788577 1 I3N3O8C20H28 A3B3C8D20E28 -293.58 6.89 -9.93 -2.13 0
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148908 53788578 1 NO2C10H11 AB2C10D11 -83.72 2.64 -8.6 -0.17 0
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148909 53788579 1 NO3C15H19 AB3C15D19 -55.45 1.97 -9.27 -0.02 0
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148910 53788580 1 N4O6C35H38 A4B6C35D38 -101.95 8.97 -9.21 -1.23 0
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148911 53788581 1 SiO3C15H32 AB3C15D32 -239.8 4.7 -9.2 0.73 0
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148912 53788582 1 NO4C16H21 AB4C16D21 -83.52 8.25 -10.26 -1.66 0
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148913 53788583 1 O7C25H40 A7B25C40 -343.54 7.27 -9.79 0.07 0
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148914 53788584 1 N3C7H15 A3B7C15 35.3 1.43 -8.43 0.68 0
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148915 53788585 1 NO2C14H21 AB2C14D21 -73.65 3.18 -8.6 -0.4 0
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148916 53788586 1 SN3H11C12 AB3C11D12 88.62 5.91 -9.51 -1.02 0
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148917 53788587 1 ClSN4O8C53H65 ABC4D8E53F65 -289.49 6.06 -8.38 -0.72 0
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148918 53788588 1 S2O3N4H20C24 A2B3C4D20E24 46.33 1.42 -9.19 -1.26 0
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148919 53788589 1 O2H16C25 A2B16C25 34.91 1.83 -8.75 -0.62 0
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148920 53788590 1 N2C17H20 A2B17C20 35.87 2.27 -8.42 0.35 0
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148921 53788591 1 ClN4O4C24H29 AB4C4D24E29 -138.42 6.93 -8.24 -0.56 0
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148922 53788592 1 ClC23H27 AB23C27 -0.23 3.79 -8.9 -0.02 0
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148923 53788593 1 OC12H16 AB12C16 -43.07 1.6 -9.4 0.22 0
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148924 53788594 1 NSO2C22H31 ABC2D22E31 -91.43 3.35 -9.36 -0.51 0
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148925 53788595 1 SN5O6C16H19 AB5C6D16E19 -196.64 7.06 -9.52 -1.08 0
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148926 53788596 1 O3N4C19H28 A3B4C19D28 -126.97 10.91 -9.05 -0.79 0