List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
395981 135027106 1 NO3H19C20 AB3C19D20 -73.66 2.05 -9.09 -0.82 0
395982 135027119 1 N5O6C15H21 A5B6C15D21 -209.39 9.3 -9.16 -0.62 0
395983 135027121 1 SO7C18H26 AB7C18D26 -290.62 1.03 -8.88 -0.2 0
395984 135027129 1 PSN3O3C16H20 ABC3D3E16F20 -105.46 4.89 -8.97 -0.98 -2
395986 135027147 1 N2O2C20H27 A2B2C20D27 -31.51 2.87 0.0 0.0 0
395987 135027150 1 ClN2C17H17 AB2C17D17 40.7 4.79 -8.84 -0.69 0
395988 135027158 1 NO5H15C16 AB5C15D16 -100.0 4.64 -9.0 -1.87 0
395989 135027161 1 ClN2O2H13C16 AB2C2D13E16 39.87 3.42 -8.74 -0.5 0
395990 135027162 2 NOC8H10 ABC8D10 -0.09 4.02 -8.58 -0.39 1
395991 135027165 1 N2H13C16 A2B13C16 93.5 3.23 0.0 0.0 0
395992 135027166 1 OF3N4H11C12 AB3C4D11E12 -112.96 4.27 -9.54 -1.07 0
395993 135027167 1 O4N5C12H13 A4B5C12D13 9.23 5.87 -9.25 -1.76 0
395994 135027168 2 N2O2C7H9 A2B2C7D9 -64.22 7.94 -8.94 -0.4 1
395995 135027169 1 N2O2S2C24H29 A2B2C2D24E29 -10.38 1.11 0.0 0.0 0
395996 135027170 2 NOSC12H14 ABCD12E14 -2.1 5.61 -7.91 -0.62 0
395997 135027172 1 BrOSiC13H19 ABCD13E19 -52.68 2.32 -9.56 -0.29 0
395998 135027173 1 NSO2C37H45 ABC2D37E45 -23.13 3.33 -7.69 -0.54 0
395999 135027174 1 NO6C16H21 AB6C16D21 -253.29 2.7 -9.61 0.08 0
396000 135027175 1 N4O5C17H22 A4B5C17D22 -158.05 5.52 -10.01 -0.36 0
396003 135027178 1 NO5C22H25 AB5C22D25 -153.98 4.96 -8.3 -0.02 0
396004 135027179 1 NO3C17H23 AB3C17D23 -121.19 2.44 -8.7 -0.46 0
396005 135027180 1 O3C9H16 A3B9C16 -134.45 1.9 -9.99 1.08 0
396006 135027181 1 BrFO3C14H14 ABC3D14E14 -162.05 2.38 -10.1 -1.24 0
396007 135027183 1 PSN3O3C15H18 ABC3D3E15F18 -98.89 1.94 -9.13 -1.02 0
396008 135027192 1 SO4C23H24 AB4C23D24 -113.35 4.83 -9.36 -0.44 0
396009 135027194 1 ClO4C26H27 AB4C26D27 -140.25 3.56 -9.64 -0.39 0
396010 135027195 1 O5C27H30 A5B27C30 -171.13 5.5 -8.97 0.03 0
396011 135027196 1 BrNO2C14H22 ABC2D14E22 -97.96 4.37 -9.11 -0.46 0
396012 135027197 1 O4H28C31 A4B28C31 21.09 3.8 -8.2 -0.61 0
396013 135027200 1 SO9H34C38 AB9C34D38 -217.02 6.96 -8.38 -0.6 0
396014 135027201 1 SO9H34C38 AB9C34D38 -225.17 5.26 -8.34 -0.84 0
396015 135027202 1 O7H28C32 A7B28C32 -163.35 2.19 -8.37 -0.55 0
396016 135027203 1 N2O4C21H24 A2B4C21D24 -68.94 2.7 -9.57 -0.5 0
396017 135027204 1 N2O4C21H24 A2B4C21D24 -68.1 5.17 -9.63 -0.44 0
396018 135027206 1 NO3C16H19 AB3C16D19 -110.38 1.66 -8.79 -0.12 0
396019 135027207 2 O2C5H6 A2B5C6 -147.92 6.59 -10.32 -0.33 0
396020 135027208 1 O3C13H18 A3B13C18 -114.48 2.36 -9.77 0.02 0
396021 135027210 1 ClN3O5C25H30 AB3C5D25E30 -196.91 3.87 -8.82 -0.6 0
396022 135027212 1 N3O5C25H31 A3B5C25D31 -185.52 3.17 -8.56 -0.45 0
396023 135027213 1 NOH15C20 ABC15D20 85.8 3.53 -8.57 -0.94 0
396024 135027214 1 NOH15C20 ABC15D20 86.08 4.23 -8.57 -0.9 0
396025 135027215 1 NO2H17C18 AB2C17D18 -1.88 2.35 -8.84 -0.3 0
396027 135027219 1 NO2C8H8 AB2C8D8 4.95 4.51 0.0 0.0 0
396028 135027220 1 NO2C10H19 AB2C10D19 -115.07 2.05 -9.25 0.7 0
396029 135027221 1 PO2C18H29 AB2C18D29 -147.82 3.84 -9.87 -0.11 0
396030 135027223 4 N2C3H5 A2B3C5 69.87 3.57 -8.36 0.57 0
396031 135027226 1 O3C8H10 A3B8C10 -87.1 3.15 -10.23 -0.4 1
396032 135027227 1 ClO4C25H30 AB4C25D30 -159.31 3.75 0.0 0.0 0
396033 135027233 1 FNO4H12C17 ABC4D12E17 -149.53 7.04 -9.84 -1.9 0
396034 135027234 1 FSO4H19C22 ABC4D19E22 -127.34 6.1 -8.28 -0.39 0