List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
121062 50754454 1 SO2N4C16H16 AB2C4D16E16 13.54 3.38 -9.18 -1.43 0
121063 50754455 1 SO2N4C17H18 AB2C4D17E18 8.1 3.6 -9.16 -1.43 0
121064 50754506 1 SO2N4H20C22 AB2C4D20E22 40.94 3.31 -9.2 -1.5 0
121065 50754508 1 O3N4C24H26 A3B4C24D26 -3.25 5.15 -8.29 -0.72 0
121066 50754591 2 OSN2H7C9 ABC2D7E9 65.98 3.46 -9.07 -1.4 0
121067 50754602 1 OSN4C20H20 ABC4D20E20 78.6 2.74 -8.35 -0.84 0
121068 50754726 1 ClN3O3H16C18 AB3C3D16E18 -18.75 6.96 -9.54 -0.71 0
121069 50754773 1 SO3N5C25H25 AB3C5D25E25 -19.36 5.15 -8.82 -1.11 0
121070 50754821 1 O2N3C14H23 A2B3C14D23 -62.09 6.01 -9.86 -0.51 0
121071 50754948 1 O2N3C16H19 A2B3C16D19 -13.84 6.18 -9.63 -0.49 0
121072 50754997 1 ClO2N3C13H14 AB2C3D13E14 -15.91 5.56 -9.91 -0.66 0
121073 50754998 1 ClO2N3C14H16 AB2C3D14E16 -22.07 5.53 -9.88 -0.64 0
121074 50755012 1 O3N4C18H18 A3B4C18D18 11.76 5.59 -9.7 -0.52 0
121075 50755076 1 SO2N6C18H20 AB2C6D18E20 -10.31 1.66 -8.48 -1.1 0
121076 50755084 1 ClO2N3H16C18 AB2C3D16E18 15.49 4.88 -9.78 -0.7 0
121077 50755101 1 ON3C21H25 AB3C21D25 -6.31 2.04 -8.82 -0.58 0
121078 50755102 1 SN4O4C21H22 AB4C4D21E22 -97.87 5.73 -7.89 -0.96 0
121079 50755103 1 FSO2N4H17C19 ABC2D4E17F19 -67.7 2.96 -8.01 -1.09 0
121080 50755119 1 O3N4C16H16 A3B4C16D16 13.37 3.22 -9.69 -0.61 0
121081 50755128 1 O2N3H19C20 A2B3C19D20 42.97 5.28 -9.51 -0.52 0
121082 50755266 1 FN3O3C19H22 AB3C3D19E22 -153.72 2.88 -9.39 -0.59 0
121083 50755297 1 ClN3O3H20C21 AB3C3D20E21 -87.64 4.47 -9.15 -0.76 0
121084 50755335 1 ON7C21H23 AB7C21D23 88.41 4.71 -8.88 -1.2 0
121085 50755364 1 N3O3C18H23 A3B3C18D23 -119.22 5.68 -9.64 -0.71 0
121086 50755372 1 ClN3O3H20C21 AB3C3D20E21 -96.95 5.37 -8.62 -0.9 0
121087 50755392 1 ClN3O3H20C21 AB3C3D20E21 -89.35 5.31 -8.49 -0.91 0
121088 50755393 1 Cl2N3O4H17C20 A2B3C4D17E20 -118.47 3.95 -8.59 -0.86 0
121089 50755394 1 ClN3O4C18H22 AB3C4D18E22 -157.11 8.83 -9.72 -0.83 0
121090 50755492 1 ClFN3O3H17C20 ABC3D3E17F20 -131.52 7.67 -8.88 -1.07 0
121091 50755493 1 SO2N4H20C22 AB2C4D20E22 47.85 7.5 -9.09 -1.26 0
121092 50755494 1 SO2N4H18C22 AB2C4D18E22 68.55 7.37 -8.92 -1.52 0
121093 50755495 1 OSN5H13C21 ABC5D13E21 152.28 5.81 -8.89 -1.57 0
121094 50755543 1 O2S2N5H15C22 A2B2C5D15E22 114.14 3.36 -8.66 -1.41 0
121095 50755597 1 N3O4C22H23 A3B4C22D23 -47.66 5.9 -9.02 -1.13 0
121096 50755704 1 SO2N4C18H24 AB2C4D18E24 -55.88 0.92 -8.69 -0.66 0
121097 50755839 1 ClO2N4C15H17 AB2C4D15E17 -56.91 3.66 -9.47 -0.69 0
121098 50755840 1 ClO2N4C17H21 AB2C4D17E21 -64.35 2.69 -9.4 -0.62 0
121099 50755841 1 O2N5C19H19 A2B5C19D19 -8.02 1.61 -9.28 -0.8 0
121100 50755897 1 O3N5C23H23 A3B5C23D23 23.61 2.52 -8.96 -0.99 0
121101 50755907 1 ClO2N3H14C17 AB2C3D14E17 19.44 6.42 -9.85 -1.23 0
121102 50755982 1 N2O5C13H14 A2B5C13D14 -163.89 8.34 -8.62 -0.98 0
121103 50756080 1 SN3O4C25H27 AB3C4D25E27 -93.59 7.37 -8.47 -0.55 0
121104 50756081 1 SO2N3C27H33 AB2C3D27E33 -45.7 3.05 -8.5 -0.57 0
121105 50756118 1 SN3O3C22H31 AB3C3D22E31 -109.04 3.72 -8.48 -0.55 0
121106 50756135 1 ClSO2N3C24H26 ABC2D3E24F26 -42.24 6.6 -8.52 -0.58 0
121107 50756136 1 SN3O3C26H31 AB3C3D26E31 -77.89 2.38 -8.47 -0.54 0
121108 50756151 1 FSO2N3C24H26 ABC2D3E24F26 -73.43 4.68 -8.67 -0.82 0
121109 50756179 1 SO2N3C26H31 AB2C3D26E31 -38.99 7.1 -8.4 -0.43 0
121110 50756282 1 SN3O3C24H35 AB3C3D24E35 -127.75 2.53 -8.43 -0.4 0
121111 50756315 1 FSO3N4C24H25 ABC3D4E24F25 -92.49 10.04 -8.88 -0.82 0
121112 50756357 1 SN4O4C24H26 AB4C4D24E26 -80.01 8.17 -8.13 -0.88 0
121113 50756383 1 FSO2N4C24H25 ABC2D4E24F25 -58.13 10.39 -9.05 -0.9 0
121114 50756407 1 N3O5C27H33 A3B5C27D33 -143.23 7.52 -8.57 -0.28 0
121115 50756408 1 N3O5C27H33 A3B5C27D33 -140.19 7.95 -7.97 -0.45 0
121116 50756433 3 NOC8H9 ABC8D9 -56.0 4.93 -8.94 -0.52 0
121117 50756457 1 O3N4C27H40 A3B4C27D40 -111.13 2.57 -8.62 -0.34 0
121118 50756459 1 FN3O3C24H26 AB3C3D24E26 -102.31 8.18 -8.92 -0.52 0
121119 50756475 1 ClN3O3C25H28 AB3C3D25E28 -71.62 2.64 -8.86 -0.5 0
121120 50756544 1 O3N4H28C29 A3B4C28D29 -8.98 3.63 -8.53 -0.49 0
121121 50756628 1 O2N4H28C29 A2B4C28D29 30.22 3.22 -9.01 -0.38 0
121122 50756629 1 O3N4C31H32 A3B4C31D32 -20.62 3.65 -8.7 -0.47 0
121123 50756639 2 ON2C15H15 AB2C15D15 24.62 3.29 -8.96 -0.42 0
121124 50756648 1 N4O4C27H32 A4B4C27D32 -82.36 2.9 -8.95 -0.38 0
121125 50756670 1 FO3N4H27C29 AB3C4D27E29 -50.08 5.4 -9.07 -0.5 0
121126 50756743 1 ClN3O3C24H26 AB3C3D24E26 -65.92 2.94 -9.03 -0.7 0
121127 50756744 1 ClN3O3C25H28 AB3C3D25E28 -71.52 2.05 -8.92 -0.55 0
121128 50756745 1 N3O4C27H33 A3B4C27D33 -109.08 3.25 -8.79 -0.42 0
121129 50756760 1 N3O4C28H35 A3B4C28D35 -111.59 4.11 -8.66 -0.42 0
121130 50756761 3 NOC9H11 ABC9D11 -79.27 2.72 -8.89 -0.55 0
121131 50756769 1 N3O4C26H31 A3B4C26D31 -102.3 2.85 -8.8 -0.43 0
121132 50756770 1 N3O3C26H31 A3B3C26D31 -70.97 4.45 -8.78 -0.41 0
121133 50756771 1 O3N4C22H32 A3B4C22D32 -87.44 3.12 -8.81 -0.41 0
121134 50756918 1 N3O3C26H29 A3B3C26D29 -77.24 2.47 -8.5 -0.56 0
121135 50756919 1 N3O3C23H31 A3B3C23D31 -114.96 2.33 -8.46 -0.48 0
121136 50756920 1 N3O4C29H29 A3B4C29D29 -65.62 2.14 -8.37 -0.55 0
121137 50756921 1 O2N4C27H34 A2B4C27D34 -39.67 5.12 -8.27 -0.55 0
121138 50756922 1 O3N4C25H28 A3B4C25D28 -63.49 6.07 -8.71 -0.73 0
121139 50756923 1 N3O3C26H29 A3B3C26D29 -73.56 0.95 -8.44 -0.5 0
121140 50756991 1 FO2N4C27H29 AB2C4D27E29 -69.99 5.55 -8.44 -1.12 0
121141 50756995 1 BrO2N4C19H23 AB2C4D19E23 -38.43 3.62 -8.6 -0.8 0
121142 50757012 1 BrO3N4C21H23 AB3C4D21E23 -90.84 4.1 -8.61 -0.82 0
121143 50757021 1 BrSN3O4C19H20 ABC3D4E19F20 -126.82 2.4 -8.77 -0.98 0
121144 50757250 1 O3N4C22H30 A3B4C22D30 -95.83 3.9 -9.16 -0.76 0
121145 50757262 1 N3O3C26H29 A3B3C26D29 -75.25 7.99 -8.59 -0.42 0
121146 50757301 2 N2O2H11C13 A2B2C11D13 -49.15 4.94 -8.73 -1.16 0
121147 50757302 2 ON2H11C13 AB2C11D13 20.27 6.37 -8.59 -1.18 0
121148 50757318 1 O3N5C24H25 A3B5C24D25 -32.14 4.88 -8.67 -1.19 0
121149 50757377 1 O3N4C29H34 A3B4C29D34 -92.21 6.63 -8.16 -0.58 0
121150 50757403 1 F2O3N4C27H28 A2B3C4D27E28 -171.86 3.9 -8.68 -0.88 0
121151 50757404 1 FO3N4C28H31 AB3C4D28E31 -140.36 6.38 -8.33 -0.94 0
121152 50757511 1 FO3N5H18C24 AB3C5D18E24 -1.77 5.2 -9.18 -1.55 0
121153 50757571 1 BrClSN2O3H16C20 ABCD2E3F16G20 -47.65 1.93 -9.72 -1.68 0
121154 50757572 1 FN2S2O3H19C21 AB2C2D3E19F21 -86.79 6.14 -9.1 -1.48 0
121155 50757573 1 FN2S2O3C23H23 AB2C2D3E23F23 -97.0 8.46 -8.8 -1.67 0
121156 50757574 1 ClSN2O4H19C21 ABC2D4E19F21 -88.87 2.65 -9.2 -1.52 0
121157 50757575 1 ClFSN2O3H18C20 ABCD2E3F18G20 -107.06 2.44 -9.7 -1.64 0
121158 50757576 1 ClSN2O3H21C22 ABC2D3E21F22 -58.08 6.39 -9.7 -1.39 0
121159 50757577 1 FN2S2O3H21C22 AB2C2D3E21F22 -105.29 5.15 -8.45 -1.61 0
121160 50757578 1 FN2S2O3H21C22 AB2C2D3E21F22 -101.04 4.78 -8.48 -1.64 0
121161 50757627 1 ClSN2O4H21C22 ABC2D4E21F22 -95.86 2.73 -9.25 -1.3 0