List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
5182 12723 1 OC7H10 AB7C10 5.45 2.14 -9.83 0.23 0
5183 12724 6 CH2 AB2 -9.93 0.63 -9.96 1.36 0
5185 12727 1 AsCl2C4H9 AB2C4D9 -61.53 3.51 -9.87 -0.87 0
5186 12728 1 AsC4H11 AB4C11 1.88 0.75 -8.83 2.24 0
5187 12729 1 O2C13H24 A2B13C24 -120.72 1.95 -9.98 0.87 0
5188 12730 1 AsCl2C5H11 AB2C5D11 -66.49 3.51 -9.87 -0.87 0
5189 12731 1 AsC5H13 AB5C13 -8.81 0.86 -9.15 2.41 0
5190 12732 2 C3H5 A3B5 30.93 1.18 -10.61 1.82 0
5191 12733 1 ClSC4H9 ABC4D9 -26.06 2.31 -8.88 0.13 0
5192 12734 1 N2C7H14 A2B7C14 10.04 2.49 -9.42 0.99 0
5193 12737 1 ClOSC4H9 ABCD4E9 -66.26 1.35 -9.18 -0.15 0
5194 12739 1 F2C7H14 A2B7C14 -131.61 1.93 -11.31 3.21 0
5195 12740 1 FOC7H13 ABC7D13 -107.58 2.74 -10.12 0.39 0
5196 12741 1 OC10H20 AB10C20 -87.48 3.39 -10.11 0.76 0
5197 12742 1 BrC9H19 AB9C19 -44.13 1.97 -10.27 0.04 0
5198 12746 2 C3H5 A3B5 -5.53 0.63 -9.04 1.6 0
5199 12748 1 NSC4H5 ABC4D5 29.6 1.21 -9.3 -0.45 0
5200 12751 1 ClOC5H7 ABC5D7 -59.16 3.97 -10.18 -0.12 0
5201 12752 1 SiC6H8 AB6C8 22.01 0.49 -9.63 -0.02 0
5202 12754 1 BrClH4C6 ABC4D6 20.11 2.48 -9.66 -0.49 0
5203 12756 2 OC3H5 AB3C5 -104.28 5.08 -10.83 0.86 0
5204 12757 2 C4H7 A4B7 -10.26 0.59 -9.96 1.35 0
5205 12758 1 H2Cl4C5 A2B4C5 3.19 1.78 -9.33 -0.89 0
5206 12759 1 NC8H11 AB8C11 6.23 2.48 -9.09 0.23 0
5207 12760 1 O2N3C4H5 A2B3C4D5 20.3 5.18 -10.36 -1.32 0
5208 12762 1 AsCl2H5C6 AB2C5D6 -15.64 3.43 -9.85 -1.09 0
5209 12763 9 CH2 AB2 -40.11 0.08 -10.36 4.15 0
5210 12764 1 ON2C6H6 AB2C6D6 36.66 2.1 -10.01 -0.81 0
5211 12765 1 OSC7H8 ABC7D8 -16.96 2.92 -8.93 -0.03 0
5212 12768 1 BrC9H15 AB9C15 -37.75 3.25 -10.28 0.17 0
5213 12769 1 OC9H12 AB9C12 -48.66 1.95 -8.74 0.53 0
5214 12771 2 ClHOC3 ABCD3 -41.89 0.24 -10.9 -2.48 0
5215 12772 1 ClNC8H10 ABC8D10 16.51 2.69 -8.64 0.04 0
5216 12776 1 Cl2N3C5H5 A2B3C5D5 36.67 2.03 -11.12 -1.39 0
5217 12778 2 NOC3H3 ABC3D3 49.13 6.14 -8.69 -1.5 0
5218 12780 2 OC4H5 AB4C5 -64.19 3.0 -9.29 0.51 0
5219 12781 1 NO3H5C6 AB3C5D6 -0.12 5.85 -9.89 -1.74 0
5220 12782 2 NC4H8 AB4C8 -6.98 2.75 -9.11 1.16 0
5221 12783 1 O2C9H14 A2B9C14 -114.17 5.11 -10.71 0.96 0
5222 12786 1 NH3F4C6 AB3C4D6 -157.33 2.38 -9.32 -0.69 0
5223 12788 1 NO3C7H7 AB3C7D7 -34.99 7.62 -9.91 -1.09 0
5224 12789 1 OH4N4C6 AB4C4D6 52.11 8.74 -9.76 -1.97 0
5225 12791 1 ON2C8H10 AB2C8D10 -20.19 3.9 -9.57 -0.11 0
5226 12793 1 PO4C6H7 AB4C6D7 -212.08 3.07 -9.72 -0.16 0
5227 12796 1 N2O2C7H8 A2B2C7D8 -67.72 4.85 -8.89 -0.04 0
5228 12797 1 NOC9H11 ABC9D11 8.64 1.85 -8.88 0.17 0
5229 12798 1 NO3C8H13 AB3C8D13 -150.56 4.34 -11.01 -0.17 0
5230 12800 4 C3H5 A3B5 -49.35 0.16 -10.03 3.96 0
5231 12801 3 OH2C3 AB2C3 -94.19 7.1 -10.48 -1.25 0
5232 12804 1 ON4H6C7 AB4C6D7 52.44 4.76 -9.57 -1.2 0
5233 12805 1 FN3C8H10 AB3C8D10 -9.34 2.33 -9.43 -0.16 0
5234 12806 1 F3C4H4N5 A3B4C4D5 -107.01 5.17 -10.17 -0.92 0
5235 12807 1 NO2C9H9 AB2C9D9 22.96 5.08 -10.02 -1.12 0
5236 12808 1 ClNS2C8H8 ABC2D8E8 38.23 2.72 -9.04 -0.66 0
5237 12809 1 O2N3C7H11 A2B3C7D11 -41.96 1.83 -10.42 -0.45 0
5238 12810 2 OC5H9 AB5C9 -123.51 5.22 -10.47 0.93 0
5239 12811 1 SN2O2C7H8 AB2C2D7E8 -53.35 4.48 -9.55 -0.99 0
5240 12813 2 OC5H9 AB5C9 -124.25 5.03 -10.84 0.86 0
5241 12815 1 Cl2C5F6 A2B5C6 -294.01 1.85 -10.54 -1.49 0
5242 12816 1 N2O2C9H14 A2B2C9D14 -102.63 2.95 -10.16 0.14 0
5243 12817 1 N2O2C9H14 A2B2C9D14 -107.86 4.05 -10.39 -0.02 0
5244 12819 1 O2H8C11 A2B8C11 -32.59 4.97 -9.03 -1.09 0
5245 12821 1 FSO3H7C8 ABC3D7E8 -144.69 7.88 -10.78 -1.42 0
5246 12824 1 ClNS2C9H10 ABC2D9E10 33.76 4.42 -8.91 -0.69 0
5247 12825 1 NO2C10H13 AB2C10D13 -81.52 2.41 -9.43 0.33 0
5248 12826 1 NO3C9H11 AB3C9D11 -112.45 2.07 -9.15 -0.14 0
5249 12829 2 SC2F4 AB2C4 -401.9 0.0 -10.63 -1.86 0
5250 12833 1 ClN2C11H13 AB2C11D13 15.59 3.55 -8.57 -0.34 0
5251 12834 1 FN2C11H13 AB2C11D13 -21.64 2.95 -8.56 -0.32 0
5252 12837 1 OC13H16 AB13C16 -31.12 2.87 -9.7 -0.4 0
5253 12839 1 ClNO2C10H12 ABC2D10E12 -91.78 2.23 -9.47 -0.1 0
5254 12840 1 NH5O5C8 AB5C5D8 -67.07 5.3 -9.85 -2.06 0
5255 12841 2 OC6H9 AB6C9 -86.86 2.19 -8.71 0.27 0
5256 12842 2 OH5C6 AB5C6 -30.76 2.45 -9.03 -0.14 0
5257 12843 1 ClNO2C10H12 ABC2D10E12 -92.3 3.49 -9.45 -0.19 0