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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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48114 10537267 1 ClSN2C10H11 ABC2D10E11 36.19 1.9 -9.13 -1.18 0
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48115 10537275 1 NSO4C9H9 ABC4D9E9 -127.34 4.86 -9.63 -0.98 0
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48116 10537284 1 N3O3C10H17 A3B3C10D17 -37.47 3.96 -8.81 -0.29 0
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48117 10537290 1 NOC15H17 ABC15D17 -13.03 2.98 -8.85 0.4 0
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48118 10537300 1 NC16H21 AB16C21 5.27 2.37 -8.0 0.33 0
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48119 10537305 1 ClN5C9H14 AB5C9D14 6.33 3.39 -8.65 -0.25 0
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48120 10537311 1 OPH13C14 ABC13D14 -27.79 5.03 -9.2 -0.71 1
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48121 10537312 1 OPH12C14 ABC12D14 4.64 5.02 0.0 0.0 0
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48122 10537314 1 O3H12C14 A3B12C14 -78.31 6.54 -9.7 -0.46 0
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48123 10537322 4 OC3H5 AB3C5 -194.09 4.43 -10.4 -0.47 0
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48124 10537323 4 OC3H5 AB3C5 -194.37 1.22 -9.75 0.86 0
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48125 10537330 1 S2O3H8C9 A2B3C8D9 -74.36 5.29 -8.69 -0.71 0
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48126 10537338 1 OC16H20 AB16C20 -56.13 4.29 -9.11 -0.22 0
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48127 10537340 1 OC16H20 AB16C20 -22.46 3.88 -9.07 -0.48 0
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48128 10537341 1 OC16H20 AB16C20 -18.86 0.62 -8.53 0.31 0
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48129 10537343 1 ON2S2C9H12 AB2C2D9E12 -5.03 5.57 -8.91 -1.18 0
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48130 10537348 1 SiO2C12H24 AB2C12D24 -156.76 1.04 -8.78 1.13 0
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48131 10537350 2 NC7H16 AB7C16 -63.79 2.62 -9.28 3.5 0
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48132 10537351 1 ClOH9C14 ABC9D14 21.95 2.14 -8.9 -0.96 0
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48133 10537356 2 ClN2H3C4 AB2C3D4 86.97 7.28 -9.75 -1.39 0
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48134 10537357 1 NO4H7C12 AB4C7D12 17.34 8.35 -8.09 -2.8 0
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48135 10537365 1 NF3C12H14 AB3C12D14 -139.09 4.12 -9.69 -0.22 0
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48136 10537373 1 NO2C14H15 AB2C14D15 -54.92 0.85 -8.13 -0.34 0
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48137 10537378 1 NSO3C10H15 ABC3D10E15 -122.92 5.42 -9.41 -0.42 0
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48138 10537391 1 ClNOC12H20 ABCD12E20 -82.19 5.1 -9.4 0.07 0
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48139 10537402 1 N2O3H10C12 A2B3C10D12 -35.71 4.51 -10.24 -0.52 0
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48140 10537404 1 O2N4H10C11 A2B4C10D11 79.24 10.03 -9.51 -1.15 0
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48141 10537431 1 N2O2C13H14 A2B2C13D14 -34.76 11.28 -9.08 -1.01 0
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48142 10537436 1 ON4C12H14 AB4C12D14 19.34 3.69 -9.12 -0.59 0
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48143 10537470 1 BrOC10H15 ABC10D15 -44.06 1.19 -9.65 0.06 0
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48144 10537474 1 NO4H9C12 AB4C9D12 -107.71 4.69 -10.59 -1.52 0
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48145 10537477 1 N3O3H9C11 A3B3C9D11 -33.18 5.73 -8.65 -1.14 0
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48146 10537485 1 NOH9C16 ABC9D16 105.73 3.73 -9.85 -1.39 0
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48147 10537490 1 NO4C11H21 AB4C11D21 -146.19 5.33 -10.9 -0.48 0
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48148 10537506 1 NS2H9C12 AB2C9D12 76.23 2.52 -8.49 -0.84 0
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48149 10537510 1 OCl3C8H13 AB3C8D13 -98.06 2.55 -10.78 -0.41 0
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48150 10537519 1 O4H12C13 A4B12C13 -116.72 6.46 -9.25 -0.74 0
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48151 10537521 1 O4H12C13 A4B12C13 -123.0 1.85 -9.48 -1.91 0
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48152 10537525 2 OH4C8 AB4C8 32.44 5.33 -9.27 -1.5 0
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48153 10537528 1 O5C11H20 A5B11C20 -196.47 2.13 -9.91 1.3 0
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48154 10537543 1 OSN2C12H12 ABC2D12E12 8.28 6.63 -9.3 -0.45 0
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48155 10537544 1 SN4C11H12 AB4C11D12 104.86 8.19 -8.28 -1.39 0
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48156 10537549 1 O2C15H20 A2B15C20 -72.22 2.67 -9.88 -0.63 0
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48157 10537562 1 OSiC14H20 ABC14D20 -11.25 3.08 -9.39 -0.63 0
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48158 10537563 1 SSiO2C10H20 ABC2D10E20 -105.78 3.88 -8.03 0.7 0
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48159 10537587 1 ON5C11H15 AB5C11D15 27.23 8.42 -8.79 0.17 0
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48160 10537597 1 NO2C14H19 AB2C14D19 -70.85 3.74 -9.58 0.35 0
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48161 10537599 1 NO2C14H19 AB2C14D19 -82.24 2.35 -9.13 0.48 0
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48162 10537628 1 O3N4C10H10 A3B4C10D10 -77.36 6.31 -8.91 -0.79 0
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48163 10537629 1 O2F3C11H13 A2B3C11D13 -224.94 3.97 -10.8 -0.23 0