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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148475 53788137 1 ClN3O3C24H26 AB3C3D24E26 -72.2 7.78 -8.62 -1.28 0
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148476 53788138 1 NO5H27C30 AB5C27D30 -124.51 12.35 -8.81 -1.14 0
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148477 53788139 1 Cl2O2C7H10 A2B2C7D10 -108.85 1.59 -10.74 -0.37 0
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148478 53788140 1 FN2O2H13C15 AB2C2D13E15 -48.52 1.64 -8.99 -0.66 0
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148479 53788141 1 NOC25H43 ABC25D43 -70.43 3.44 -9.42 1.02 0
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148480 53788142 1 N3C10H25 A3B10C25 -37.52 2.2 -8.93 2.97 0
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148481 53788143 1 H3Br5C10 A3B5C10 66.84 2.0 -9.46 -1.75 0
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148482 53788144 1 NO2C11H23 AB2C11D23 -119.12 2.48 -8.64 2.11 0
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148483 53788145 1 FCl3O4N10C30H56 AB3C4D10E30F56 -214.55 5.34 -8.41 -0.93 0
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148484 53788146 1 ClFO2N3C9H15 ABC2D3E9F15 -131.7 4.11 -9.06 -0.1 0
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148485 53788147 1 Cl2O2N3C9H15 A2B2C3D9E15 -92.76 4.62 -9.08 -0.2 0
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148486 53788148 2 N2C6H13 A2B6C13 -16.47 2.29 -8.66 2.28 0
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148487 53788149 1 ClSN4C12H15 ABC4D12E15 55.13 2.47 -8.49 -0.47 0
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148488 53788150 1 ON4C25H30 AB4C25D30 6.89 3.48 -8.95 -0.07 0
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148489 53788152 2 ON2C12H12 AB2C12D12 42.93 8.39 -9.14 -0.48 0
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148490 53788153 1 BrN4H5C6 AB4C5D6 102.12 1.51 -9.42 -0.81 0
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148491 53788154 1 SO2N5H9C13 AB2C5D9E13 171.16 12.39 -9.52 -2.72 0
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148492 53788155 2 N2H5C6 A2B5C6 115.61 1.29 -9.42 -0.7 0
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148493 53788156 2 C7H13 A7B13 -58.8 0.13 -10.27 3.75 0
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148494 53788157 1 O3C27H52 A3B27C52 -231.87 1.33 -9.35 0.71 0
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148495 53788158 1 O3C23H40 A3B23C40 -189.41 3.93 -9.85 0.61 0
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148496 53788159 1 OC16H16 AB16C16 6.17 3.15 -8.85 -0.37 0
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148497 53788160 1 SH3C4N5 AB3C4D5 140.7 3.84 -8.94 -2.08 0
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148498 53788161 1 PC11H21 AB11C21 -49.21 1.36 -8.47 3.23 0
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148499 53788162 1 ON3C25H37 AB3C25D37 -64.65 5.44 -7.95 0.19 0
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148500 53788163 1 ClN2H9C13 AB2C9D13 73.23 1.51 -9.13 -1.07 0
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148501 53788164 1 SiC30H36 AB30C36 26.56 0.77 -8.9 0.02 0
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148502 53788165 2 N2H5C6 A2B5C6 117.49 2.39 -8.96 -0.67 0
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148503 53788166 1 NO2C21H31 AB2C21D31 -81.2 4.37 -8.28 0.46 0
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148504 53788167 1 N7O16C71H85 A7B16C71D85 -370.36 24.23 -8.43 -2.57 0
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148505 53788168 1 N2O3C13H14 A2B3C13D14 -103.56 4.94 -8.94 -0.28 0
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148506 53788169 1 NO3C14H15 AB3C14D15 -106.11 8.0 -9.5 -0.82 0
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148507 53788170 1 NO3C14H17 AB3C14D17 -126.86 9.67 -9.62 -0.33 0
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148508 53788171 1 N2O3C14H16 A2B3C14D16 -102.62 6.05 -8.72 -0.21 0
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148509 53788172 1 NO3C15H19 AB3C15D19 -125.45 2.61 -9.13 0.14 0
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148510 53788173 1 NO3C14H23 AB3C14D23 -125.52 3.7 -8.55 0.08 0
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148511 53788174 1 NOC10H19 ABC10D19 -30.59 5.51 -8.82 1.38 -1
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148512 53788175 1 NOC10H18 ABC10D18 -32.7 4.32 0.0 0.0 0
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148513 53788176 1 N3O6C22H37 A3B6C22D37 -300.51 8.88 -9.22 0.41 0
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148514 53788177 1 S2O4C17H30 A2B4C17D30 -226.46 7.78 -9.06 -0.62 0
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148515 53788178 1 ON4C25H32 AB4C25D32 -1.84 2.06 -8.45 -0.21 0
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148516 53788179 1 N2O3H6C8 A2B3C6D8 -0.23 9.87 -8.64 -1.16 0
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148517 53788180 1 OSN2C20H24 ABC2D20E24 -2.57 2.74 -7.78 -0.29 0
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148518 53788181 1 N2O3C17H22 A2B3C17D22 -122.42 5.89 -8.4 -0.27 0
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148519 53788182 1 N3H13C14 A3B13C14 85.94 5.0 -8.49 -0.61 0
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148520 53788183 1 NOC8H13 ABC8D13 -52.28 3.89 -8.32 1.18 0
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148521 53788184 24 CH2 AB2 -115.38 0.14 -10.34 3.82 0
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148522 53788185 1 OC31H50 AB31C50 -108.97 1.87 -8.6 0.57 0
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148523 53788186 1 ClO2N3C24H24 AB2C3D24E24 12.04 0.69 -9.37 -1.41 0
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148524 53788187 1 ClC11H15 AB11C15 -19.42 2.15 -9.1 0.14 0