List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
327075 126688962 1 NO5H21C23 AB5C21D23 -70.65 0.61 -8.49 -1.39 0
327076 126688963 2 NO3C12H13 AB3C12D13 -85.21 7.93 -8.3 -0.52 0
327077 126688964 1 NO5C23H23 AB5C23D23 -84.38 3.56 -8.35 -0.7 0
327078 126688965 1 OPN3C9H12 ABC3D9E12 174.4 2.2 -9.34 -0.25 0
327079 126688966 1 NSO10C14H15 ABC10D14E15 -382.71 0.49 -10.01 -1.29 0
327080 126688967 1 O2N4F5H15C25 A2B4C5D15E25 -181.84 2.71 -9.38 -1.48 0
327081 126688968 1 O3F5N5C34H34 A3B5C5D34E34 -272.75 5.22 -9.43 -1.34 0
327082 126688969 1 OCl2F3N5H26C29 AB2C3D5E26F29 -82.58 2.56 -9.31 -1.16 0
327083 126688970 1 NSO10C14H15 ABC10D14E15 -371.66 8.15 -9.94 -1.1 0
327084 126688971 1 O2C13H24 A2B13C24 -142.59 2.07 -10.44 1.05 0
327085 126688972 1 IOC12H23 ABC12D23 -79.28 4.0 -9.72 -1.25 0
327086 126688973 1 OF5N5H22C29 AB5C5D22E29 -121.14 5.8 -9.31 -1.44 0
327087 126688974 2 N2O5C16H20 A2B5C16D20 -406.99 10.19 -8.61 -1.25 0
327088 126688975 1 NSO8C14H23 ABC8D14E23 -380.95 2.25 -9.88 -0.87 0
327089 126688976 1 IN3O3C13H14 AB3C3D13E14 -86.6 5.77 -8.63 -1.22 0
327090 126688981 1 NO4C14H17 AB4C14D17 -121.76 2.68 -8.64 0.01 0
327091 126688982 1 NSO10C11H15 ABC10D11E15 -438.26 5.75 -10.26 -1.37 0
327092 126688984 1 F3N5O6C39H44 A3B5C6D39E44 -333.58 7.67 -9.6 -0.97 0
327093 126688986 1 NO2C15H19 AB2C15D19 -72.65 2.95 -8.86 0.39 0
327094 126688987 1 NSO10C19H31 ABC10D19E31 -487.41 4.93 -9.41 -0.66 0
327095 126688988 1 NO2C15H19 AB2C15D19 -72.24 1.81 -8.8 0.2 0
327096 126688991 1 NO2C12H21 AB2C12D21 -106.02 4.18 -8.49 0.53 0
327097 126688992 1 NO2C13H23 AB2C13D23 -108.98 1.99 -8.54 0.62 0
327098 126688994 1 NO2C13H23 AB2C13D23 -111.66 2.7 -8.53 0.75 0
327099 126688996 1 NSO12C15H15 ABC12D15E15 -460.29 7.11 -10.06 -1.73 0
327100 126688997 1 NSO10C17H27 ABC10D17E27 -471.36 6.41 -10.33 -1.3 0
327101 126689001 1 NSO8C11H13 ABC8D11E13 -325.79 3.48 -10.03 -1.19 0
327102 126689002 2 NOC12H17 ABC12D17 -115.92 6.37 -8.42 0.62 0
327103 126689003 2 NOC12H16 ABC12D16 -109.78 2.62 -9.54 -0.5 0
327104 126689004 1 NO2C15H19 AB2C15D19 -63.54 3.1 -9.09 0.13 0
327105 126689005 1 NO2C15H19 AB2C15D19 -63.44 1.75 -8.72 0.03 0
327106 126689007 1 NSO10C21H31 ABC10D21E31 -474.93 6.08 -10.12 -1.06 0
327107 126689012 1 N2O2C13H14 A2B2C13D14 -39.09 2.29 -9.08 -0.5 0
327108 126689014 1 NSO10C23H35 ABC10D23E35 -449.98 3.86 -9.86 -0.94 0
327109 126689015 1 N2O2C15H20 A2B2C15D20 -50.33 1.39 -8.55 0.11 0
327110 126689016 1 NSO10C23H35 ABC10D23E35 -496.4 4.09 -9.95 -0.91 0
327111 126689018 2 ON2C10H19 AB2C10D19 -140.35 1.45 -9.18 1.33 0
327112 126689020 1 NSO12C17H19 ABC12D17E19 -480.67 5.66 -10.03 -1.5 0
327113 126689021 1 NSO10C23H23 ABC10D23E23 -389.86 4.73 -9.9 -1.11 0
327114 126689027 2 NOC5H9 ABC5D9 -88.58 6.33 -8.52 0.51 0
327115 126689028 1 OF3N6C27H27 AB3C6D27E27 -60.33 6.04 -8.95 -0.93 0
327116 126689030 1 OF3N5H28C35 AB3C5D28E35 -3.93 3.7 -9.09 -1.52 0
327117 126689033 1 F4N4O4C27H28 A4B4C4D27E28 -300.12 7.22 -9.04 -1.26 0
327118 126689034 1 N3H19C20 A3B19C20 85.78 5.55 -8.14 -0.85 0
327119 126689035 2 ON2H9C10 AB2C9D10 81.72 9.48 -8.67 -1.72 0
327120 126689036 2 ON2H9C10 AB2C9D10 78.58 6.73 -8.6 -1.63 0
327121 126689039 1 SF4O4N7C36H39 AB4C4D7E36F39 -216.39 5.23 -8.89 -1.62 0
327122 126689040 1 O3F4N7C36H39 A3B4C7D36E39 -193.64 9.78 -9.64 -1.38 0
327123 126689041 1 O3F4N7H31C32 A3B4C7D31E32 -178.08 8.86 -9.68 -1.43 0
327124 126689043 1 Cl2F3N6C15H17 A2B3C6D15E17 -110.07 7.59 -8.79 -0.58 0
327125 126689047 1 Cl2F3N6C15H17 A2B3C6D15E17 -108.45 7.55 -8.76 -0.53 0
327126 126689051 1 OF3N5H32C33 AB3C5D32E33 -52.57 5.44 -9.02 -1.48 0
327127 126689056 1 ClN2O2H9C17 AB2C2D9E17 70.68 6.44 -9.29 -2.08 0
327128 126689057 1 SN3O4C28H33 AB3C4D28E33 -132.36 5.82 -8.95 -0.74 0
327129 126689058 1 N2C27H30 A2B27C30 68.83 1.31 -8.33 -0.15 0
327130 126689061 1 N2C23H38 A2B23C38 -35.04 4.6 -8.11 0.66 0
327131 126689064 1 N3O3C11H13 A3B3C11D13 -94.17 5.76 -9.99 -0.76 0
327132 126689065 1 N2O2H10C17 A2B2C10D17 83.81 5.51 -9.14 -1.49 0
327133 126689066 1 N2C27H30 A2B27C30 69.1 1.49 -8.36 -0.16 0
327134 126689067 1 N2O2H10C17 A2B2C10D17 80.5 3.83 -9.27 -1.89 0
327135 126689070 1 N2O4C11H20 A2B4C11D20 -206.99 3.69 -9.65 0.34 0
327136 126689072 1 O2N7C19H23 A2B7C19D23 2.53 5.26 -8.69 -0.56 0
327137 126689073 1 ClO2N3H16C22 AB2C3D16E22 100.52 2.73 -8.91 -1.51 0
327138 126689076 1 ClO2N3H16C22 AB2C3D16E22 99.15 2.88 -8.92 -1.71 0
327139 126689077 1 FNO4C28H30 ABC4D28E30 -171.87 3.55 -8.4 -0.17 0
327140 126689083 1 FNO4C34H34 ABC4D34E34 -130.62 1.32 -8.24 -0.31 0
327141 126689084 1 NO6C14H25 AB6C14D25 -284.7 5.45 -9.6 0.59 0
327142 126689088 1 FNO4C35H36 ABC4D35E36 -130.48 4.14 -8.19 -0.13 0
327143 126689091 1 FNO4H26C27 ABC4D26E27 -154.17 4.31 -8.6 -0.33 0
327144 126689095 1 BrN2O3C14H15 AB2C3D14E15 -66.82 5.59 -8.87 -0.38 0
327145 126689100 1 NO3C7H13 AB3C7D13 -135.46 3.6 -9.33 1.39 0
327146 126689101 1 NO4C19H21 AB4C19D21 -132.72 7.81 -9.47 -0.56 0
327147 126689104 1 FNO5C29H30 ABC5D29E30 -205.8 1.79 -8.35 -0.19 0
327149 126689107 1 NO3C19H21 AB3C19D21 -89.79 2.95 -8.09 0.1 0
327150 126689108 1 ON2Cl4H6C12 AB2C4D6E12 62.42 5.71 -9.48 -1.53 0
327151 126689109 1 FN2O2H33C34 AB2C2D33E34 -20.41 5.11 -8.55 -0.21 0
327152 126689111 1 OF2N4S8C83H104 AB2C4D8E83F104 -39.82 2.04 -8.0 -2.04 0
327153 126689113 1 NO5C25H47 AB5C25D47 -319.11 5.11 -9.97 0.64 0
327154 126689114 1 NO7C26H41 AB7C26D41 -269.01 7.55 -10.34 -1.47 0
327155 126689117 2 NOS2C16H19 ABC2D16E19 -11.18 0.88 -7.95 -1.82 0
327156 126689118 2 NOSC30H45 ABCD30E45 -146.97 1.0 -7.88 -1.77 0
327157 126689119 1 SF4O4N7C40H43 AB4C4D7E40F43 -219.34 6.32 -8.64 -1.29 0
327158 126689122 2 BrINOSC14H17 ABCDEF14G17 2.27 2.34 -8.5 -2.12 0
327159 126689125 1 N2F4C19H20 A2B4C19D20 -147.02 3.15 -9.43 -0.39 0
327160 126689126 2 NOSC22H29 ABCD22E29 -70.11 2.85 -7.96 -1.79 0
327161 126689127 2 NOSC22H29 ABCD22E29 -59.84 3.3 -7.97 -1.75 0
327162 126689128 1 Cl2N2O4H16C17 A2B2C4D16E17 -77.89 6.22 -9.89 -1.68 0
327163 126689130 1 N3H11C12 A3B11C12 144.13 0.94 -8.26 -0.93 0
327164 126689131 1 IN2O2C17H25 AB2C2D17E25 -78.55 1.56 -8.82 -1.47 0
327165 126689134 1 F2O2N5C26H29 A2B2C5D26E29 -109.97 4.24 -8.64 -1.05 0
327166 126689135 1 O2N5C25H29 A2B5C25D29 -0.78 2.39 -8.52 -0.9 0
327167 126689138 1 HSO4C6F11 ABC4D6E11 -696.57 1.9 -12.65 -1.97 0
327168 126689139 1 OF2N4H16C19 AB2C4D16E19 -56.99 3.12 -8.83 -1.29 0
327169 126689141 1 BrN2O2C13H13 AB2C2D13E13 -47.44 5.79 -9.2 -1.28 0
327170 126689143 1 F2O2N5C24H27 A2B2C5D24E27 -106.85 4.11 -8.67 -1.07 0
327171 126689144 1 O2N5C26H31 A2B5C26D31 -19.52 3.29 -8.57 -0.89 0
327172 126689147 1 FO2N5C26H30 AB2C5D26E30 -72.87 2.64 -8.76 -1.19 0
327173 126689148 1 FON4H17C19 ABC4D17E19 -11.05 3.1 -8.7 -1.11 0
327174 126689151 1 BrFN2O2C15H16 ABC2D2E15F16 -104.5 7.33 -9.08 -1.14 0
327175 126689154 1 FSO4C6H11 ABC4D6E11 -236.4 3.92 -11.43 -0.89 0