List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
109057 50271000 3 FN2O2C14H15 AB2C2D14E15 -327.15 10.25 -8.68 -0.82 0
109058 50271001 1 FN6O6C37H43 AB6C6D37E43 -248.36 7.03 -8.62 -0.48 0
109059 50271002 1 FN6O6C38H45 AB6C6D38E45 -259.65 9.99 -8.76 -0.46 0
109060 50271005 1 FN6O6C38H45 AB6C6D38E45 -265.36 10.15 -8.74 -0.56 0
109061 50271006 1 FN6O6C39H47 AB6C6D39E47 -268.14 5.36 -8.68 -0.57 0
109062 50271007 1 FN6O6C40H49 AB6C6D40E49 -276.16 7.57 -8.68 -0.46 0
109063 50271074 1 FN6O6C37H43 AB6C6D37E43 -254.26 8.1 -8.9 -0.7 0
109064 50271082 1 F2O5N6C39H40 A2B5C6D39E40 -239.1 7.72 -8.91 -0.74 0
109065 50271095 1 F3O4N5C32H34 A3B4C5D32E34 -260.5 14.55 -8.85 -0.56 0
109066 50271141 1 F2O4N5C33H37 A2B4C5D33E37 -223.34 9.0 -8.98 -0.63 0
109067 50271246 1 ClO5N6C41H49 AB5C6D41E49 -197.55 12.24 -8.52 -0.8 0
109068 50271247 1 ClO5N6C39H47 AB5C6D39E47 -200.57 7.61 -8.7 -0.56 0
109069 50271248 1 ClO5N6C36H41 AB5C6D36E41 -177.91 14.79 -8.48 -1.17 0
109070 50271249 1 ClO5N6C39H47 AB5C6D39E47 -183.74 5.09 -8.82 -0.57 0
109071 50271268 2 FN3O3C20H21 AB3C3D20E21 -276.19 9.68 -8.38 -0.63 0
109072 50271414 1 ClO5N6C35H39 AB5C6D35E39 -167.3 10.41 -8.56 -0.8 0
109073 50271415 1 ClO5N6C37H43 AB5C6D37E43 -168.61 15.07 -8.59 -0.6 0
109074 50271416 1 ClO5N6C38H45 AB5C6D38E45 -189.67 4.99 -8.64 -0.6 0
109075 50271496 1 F3O5N6C39H39 A3B5C6D39E39 -278.79 5.25 -9.07 -0.74 0
109076 50271713 1 ClF2O5N6C36H41 AB2C5D6E36F41 -289.68 4.83 -8.58 -0.68 0
109077 50271749 1 FO5N6C41H51 AB5C6D41E51 -254.36 7.26 -8.62 -0.45 0
109078 50271886 1 SF2O4N5C35H39 AB2C4D5E35F39 -202.3 6.57 -8.52 -0.49 0
109079 50271995 1 F2O5N6C41H44 A2B5C6D41E44 -240.93 5.94 -8.76 -0.92 0
109080 50271996 1 FN6O6C42H47 AB6C6D42E47 -234.52 11.48 -8.74 -0.55 0
109081 50271997 1 FN6O6C42H47 AB6C6D42E47 -234.62 13.46 -8.73 -0.81 0
109082 50271998 1 FO5N6C38H47 AB5C6D38E47 -237.38 8.37 -8.6 -0.4 0
109083 50271999 1 F2O5N6C41H42 A2B5C6D41E42 -230.63 4.06 -8.78 -0.72 0
109084 50272000 1 O5N6C41H44 A5B6C41D44 -137.95 11.07 -8.71 -0.65 0
109085 50272001 1 FO5N6C41H43 AB5C6D41E43 -181.32 5.57 -8.77 -0.9 0
109086 50272002 1 FO5N6C42H45 AB5C6D42E45 -187.05 8.78 -8.68 -0.64 0
109087 50272003 1 O5N6C42H46 A5B6C42D46 -145.16 8.46 -8.78 -0.52 0
109088 50272004 1 FO5N6C41H43 AB5C6D41E43 -185.01 14.36 -8.84 -0.57 0
109089 50272005 1 F2O5N6C41H42 A2B5C6D41E42 -226.9 12.34 -8.86 -0.81 0
109090 50272006 1 FO5N6C41H43 AB5C6D41E43 -189.59 12.85 -8.32 -0.73 0
109091 50272018 1 FN6O6C37H45 AB6C6D37E45 -257.04 14.84 -8.97 -0.48 0
109092 50272053 1 ClF2O5N6C35H39 AB2C5D6E35F39 -278.03 11.16 -9.07 -0.77 0
109093 50272072 1 F2O4N5C36H41 A2B4C5D36E41 -227.72 3.84 -8.48 -0.67 0
109094 50272417 1 ClF2O5N6C42H45 AB2C5D6E42F45 -256.61 5.18 -8.43 -0.76 0
109095 50272567 1 F2N5O5C36H41 A2B5C5D36E41 -259.84 6.51 -9.11 -0.74 0
109096 50272826 1 O5N6C42H46 A5B6C42D46 -143.41 10.42 -8.59 -0.64 0
109097 50272832 1 O5N6C38H46 A5B6C38D46 -174.47 10.51 -8.59 -0.52 0
109098 50272836 1 O5N6C40H50 A5B6C40D50 -190.22 9.63 -8.59 -0.47 0
109099 50272837 6 NOC6H7 ABC6D7 -195.99 12.51 -8.58 -0.52 0
109100 50272838 2 N3O3C19H23 A3B3C19D23 -191.75 5.52 -8.67 -0.51 0
109101 50272839 3 N2O2C13H16 A2B2C13D16 -216.65 12.9 -8.57 -0.48 0
109102 50272848 1 F2O5N6C41H44 A2B5C6D41E44 -247.67 6.98 -8.91 -0.76 0
109103 50272849 1 FO5N6C34H39 AB5C6D34E39 -220.47 9.07 -8.96 -0.59 0
109104 50272888 1 O4N5C36H43 A4B5C36D43 -132.91 7.36 -8.71 -0.89 0
109105 50273010 1 O5N6C41H50 A5B6C41D50 -189.15 7.15 -8.6 -0.49 0
109106 50273092 1 ClFO5N6C37H42 ABC5D6E37F42 -225.14 5.43 -8.94 -0.85 0
109107 50273093 1 ClFO5N6C38H44 ABC5D6E38F44 -224.93 7.26 -9.1 -0.76 0
109108 50273094 1 ClFN6O6C36H40 ABC6D6E36F40 -258.06 8.1 -8.95 -1.0 0
109109 50273253 1 ClO4N5C34H38 AB4C5D34E38 -128.78 1.27 -8.79 -0.62 0
109110 50273352 1 F3O5N6C39H39 A3B5C6D39E39 -275.69 7.97 -8.81 -0.64 0
109111 50273353 1 FO5N6C39H41 AB5C6D39E41 -190.87 5.75 -8.67 -0.57 0
109112 50273377 1 O5N6C40H48 A5B6C40D48 -178.73 12.59 -8.45 -0.69 0
109113 50273380 1 O5N6C43H54 A5B6C43D54 -191.7 5.32 -8.66 -0.57 0
109114 50273448 1 F2O5N6C38H38 A2B5C6D38E38 -224.83 5.23 -8.54 -0.84 0
109115 50273449 1 FN6O6C39H41 AB6C6D39E41 -221.88 6.37 -8.42 -0.63 0
109116 50273609 1 BrFO4N5C34H37 ABC4D5E34F37 -163.46 9.69 -8.74 -0.65 0
109117 50273610 1 SO4N7C31H37 AB4C7D31E37 -92.4 9.72 -8.68 -1.02 0
109118 50273611 1 N5O6C36H43 A5B6C36D43 -196.02 11.43 -8.38 -0.37 0
109119 50273612 1 SO4N7C33H41 AB4C7D33E41 -112.41 12.99 -8.65 -0.72 0
109120 50273613 1 O4N5C36H43 A4B5C36D43 -143.36 7.47 -8.52 -0.44 0
109121 50273614 1 ClFO4N5C34H37 ABC4D5E34F37 -168.99 6.27 -8.78 -0.73 0
109122 50273615 1 F3O4N5C35H38 A3B4C5D35E38 -281.54 9.15 -8.8 -0.49 0
109123 50273616 1 FO4N5C34H38 AB4C5D34E38 -166.63 11.23 -8.76 -0.48 0
109124 50273617 1 SO4N7C32H39 AB4C7D32E39 -93.46 9.77 -8.82 -0.76 0
109125 50273618 1 ClO5N6C35H39 AB5C6D35E39 -168.9 3.47 -8.94 -0.7 0
109126 50273619 1 ClO5N6C37H43 AB5C6D37E43 -164.77 5.7 -8.79 -0.58 0
109127 50273662 1 F2O5N6C39H48 A2B5C6D39E48 -292.1 4.79 -9.11 -0.66 0
109128 50273677 1 F3O5N6C43H47 A3B5C6D43E47 -302.3 5.46 -8.85 -0.73 0
109129 50273796 1 FO4N5C35H40 AB4C5D35E40 -169.05 4.98 -8.74 -0.54 0
109130 50273854 1 FO4N5C35H42 AB4C5D35E42 -191.52 7.48 -9.06 -0.63 0
109131 50273855 1 FO4N5C35H40 AB4C5D35E40 -178.43 6.37 -9.01 -0.61 0
109132 50273856 1 FO4N5C36H42 AB4C5D36E42 -185.62 5.72 -9.04 -0.56 0
109133 50273859 1 FO4N5C36H42 AB4C5D36E42 -188.88 8.83 -8.95 -0.64 0
109134 50273866 1 FO4N5C33H38 AB4C5D33E38 -180.59 10.43 -8.56 -0.55 0
109135 50273867 1 ClFO4N5C37H37 ABC4D5E37F37 -158.97 7.96 -8.71 -0.82 0
109136 50273919 1 FO4N5C33H38 AB4C5D33E38 -165.76 7.52 -8.71 -0.46 0
109137 50274040 1 F2O4N5C38H39 A2B4C5D38E39 -200.84 8.0 -8.94 -0.71 0
109138 50274091 1 F3O5N6C43H45 A3B5C6D43E45 -290.34 11.34 -9.0 -0.71 0
109139 50274092 1 F3O5N6C43H45 A3B5C6D43E45 -296.54 7.49 -8.7 -0.9 0
109140 50274132 1 F3O5N6H37C38 A3B5C6D37E38 -270.63 11.5 -8.85 -0.71 0
109141 50274133 1 FO5N6C38H39 AB5C6D38E39 -180.65 6.24 -8.73 -0.75 0
109142 50274147 1 O4N5C36H45 A4B5C36D45 -151.18 6.27 -8.58 -0.46 0
109143 50274148 1 Cl2O4N5C34H39 A2B4C5D34E39 -152.75 2.77 -8.66 -0.61 0
109144 50274149 1 ClO4N5C34H40 AB4C5D34E40 -147.59 8.75 -8.47 -0.38 0
109145 50274150 1 Cl2O4N5C34H39 A2B4C5D34E39 -158.08 11.51 -8.6 -0.6 0
109146 50274151 1 BrO4N5C34H40 AB4C5D34E40 -137.32 8.1 -8.82 -1.08 0
109147 50274152 1 O5N6C40H50 A5B6C40D50 -188.64 5.81 -8.6 -0.37 0
109148 50274162 1 FO5N6C43H49 AB5C6D43E49 -207.4 11.89 -8.48 -0.48 0
109149 50274240 1 FO5N6C35H41 AB5C6D35E41 -214.48 6.73 -9.01 -0.82 0
109150 50274468 1 FO5N6C34H39 AB5C6D34E39 -220.11 9.91 -8.65 -0.53 0
109151 50274538 1 O5N6C40H50 A5B6C40D50 -193.17 6.16 -8.77 -0.45 0
109152 50274631 1 F2O5N6C40H42 A2B5C6D40E42 -238.96 7.21 -8.74 -0.4 0
109153 50274690 1 FO5N6C41H45 AB5C6D41E45 -204.75 6.23 -8.79 -0.62 0
109154 50274787 1 ClFO4N5H35C36 ABC4D5E35F36 -144.64 1.23 -8.75 -0.84 0
109155 50274886 1 O5N6C41H46 A5B6C41D46 -158.85 16.62 -8.47 -1.11 0
109156 50274908 1 FO4N5C34H40 AB4C5D34E40 -183.07 4.26 -8.67 -0.86 0