List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
265375 103518989 1 BrN3O4C11H14 AB3C4D11E14 -68.1 7.51 -10.18 -2.0 0
265376 103519021 1 BrN3O4C11H14 AB3C4D11E14 -76.72 2.67 -9.79 -1.74 0
265377 103519022 1 BrN3O4C12H14 AB3C4D12E14 -76.93 5.56 -9.94 -1.8 0
265378 103519056 1 BrSN2O4H7C12 ABC2D4E7F12 -10.62 5.27 -9.56 -2.2 0
265379 103519066 1 BrSN2O4H7C12 ABC2D4E7F12 -11.25 2.56 -9.52 -2.25 0
265380 103519068 1 BrS2N3O4H6C10 AB2C3D4E6F10 -24.11 4.9 -9.22 -2.51 0
265381 103519071 1 BrSO4N6H7C9 ABC4D6E7F9 12.27 6.18 -9.61 -2.35 0
265382 103519080 1 BrClSN2O4H6C12 ABCD2E4F6G12 -20.16 2.47 -9.56 -2.28 0
265383 103519121 1 BrSN2H11C12 ABC2D11E12 61.6 3.27 -8.88 -0.8 0
265384 103519215 1 BrOSN2C8H11 ABCD2E8F11 -14.24 3.79 -8.95 -0.83 0
265385 103519289 1 BrN3O3C12H12 AB3C3D12E12 3.04 6.27 -9.34 -1.54 0
265386 103519290 1 BrO2N3C13H16 AB2C3D13E16 17.03 6.13 -9.55 -1.52 0
265387 103519295 1 FBr2O2N3H8C12 AB2C2D3E8F12 8.46 5.35 -9.67 -1.61 0
265388 103519296 1 BrO2N3C11H14 AB2C3D11E14 9.15 5.66 -9.51 -1.25 0
265389 103519297 1 BrClO2N3H11C13 ABC2D3E11F13 36.16 5.72 -9.64 -1.5 0
265390 103519551 1 BrO2N4C12H15 AB2C4D12E15 110.15 7.78 -9.33 -1.24 0
265391 103519552 1 BrO2N4C11H15 AB2C4D11E15 17.46 5.18 -9.37 -1.59 0
265392 103519553 1 BrO2N4C11H15 AB2C4D11E15 13.68 4.16 -9.42 -1.58 0
265393 103519554 1 BrO2N4C11H15 AB2C4D11E15 25.67 4.08 -9.38 -1.63 0
265394 103519565 1 BrO2N4C9H13 AB2C4D9E13 20.85 5.73 -9.55 -1.54 0
265395 103519567 1 BrO2N4C10H13 AB2C4D10E13 46.49 5.22 -9.51 -1.56 0
265396 103519572 1 BrO3N4C13H13 AB3C4D13E13 13.8 5.94 -9.39 -1.65 0
265397 103519575 1 BrO3N4C13H13 AB3C4D13E13 9.0 5.93 -8.8 -1.63 0
265398 103519577 1 BrO2N4C14H21 AB2C4D14E21 10.73 2.52 -8.83 -1.86 0
265399 103519586 1 BrO2N5C12H18 AB2C5D12E18 43.26 5.8 -9.03 -1.28 0
265400 103519888 1 N2C19H24 A2B19C24 54.24 0.99 -8.73 -0.3 0
265401 103520033 1 ClNSO4C12H14 ABCD4E12F14 -140.54 4.64 -9.86 -1.4 0
265402 103520034 1 NSO5C14H19 ABC5D14E19 -188.79 8.28 -9.62 -1.05 0
265403 103520042 1 IN2O4C9H9 AB2C4D9E9 -10.3 5.23 -9.9 -1.83 0
265404 103520045 1 ClON2C11H15 ABC2D11E15 -42.32 7.12 -9.11 -0.58 0
265405 103520059 1 IN2O4H7C8 AB2C4D7E8 -3.32 5.22 -9.89 -1.87 0
265406 103520078 1 O2N3C16H19 A2B3C16D19 -15.4 4.7 -8.89 -0.57 0
265407 103520079 1 ClNO6C13H14 ABC6D13E14 -158.13 6.46 -10.02 -1.73 0
265408 103520080 1 BrNO2C15H20 ABC2D15E20 -76.49 6.34 -9.46 -0.04 0
265409 103520084 1 FNOH10C16 ABCD10E16 41.87 5.57 -9.46 -0.83 0
265410 103520094 1 BrNOH10C14 ABCD10E14 59.47 4.23 -9.28 -0.56 0
265411 103520128 1 SN2O2H12C13 AB2C2D12E13 5.66 5.56 -8.99 -0.8 0
265412 103520189 1 SO2N3H13C14 AB2C3D13E14 0.6 3.65 -9.18 -0.77 0
265413 103520191 1 ClNO2S2H8C10 ABC2D2E8F10 -12.84 2.81 -9.04 -1.42 0
265414 103520192 1 NSO2C8H13 ABC2D8E13 -74.92 1.12 -8.94 -0.33 0
265415 103520206 1 NO2S2H9C10 AB2C2D9E10 -12.69 3.85 -8.8 -1.23 0
265416 103520214 1 BrOSN2H9C10 ABCD2E9F10 27.07 1.95 -9.02 -0.96 0
265417 103520215 1 ClOSN2H9C10 ABCD2E9F10 16.2 4.12 -9.12 -0.99 0
265418 103520216 1 BrClNOSH9C11 ABCDEF9G11 7.22 1.85 -8.98 -0.96 0
265419 103520217 1 BrFNOSH9C11 ABCDEF9G11 -30.41 1.75 -8.96 -0.86 0
265420 103520218 1 SN2O2C12H14 AB2C2D12E14 -42.43 5.91 -8.54 0.03 0
265421 103520219 1 ClOS2N3H6C7 ABC2D3E6F7 51.44 3.13 -9.01 -1.54 0
265422 103520222 1 SN2O2C13H16 AB2C2D13E16 -42.36 6.71 -8.48 0.13 0
265423 103520223 1 BrNO2S2H8C10 ABC2D2E8F10 -1.72 2.82 -8.95 -1.18 0
265424 103520226 1 ClNSO2H10C12 ABCD2E10F12 -25.59 3.57 -8.8 -1.1 0
265425 103520227 1 NSO2C12H13 ABC2D12E13 -35.22 2.17 -8.88 -0.58 0
265426 103520228 1 NSO3C10H13 ABC3D10E13 -81.4 2.55 -9.04 -0.61 0
265427 103520229 1 NSO3C10H17 ABC3D10E17 -110.26 2.97 -8.69 -0.07 0
265428 103520230 1 NSO2C10H15 ABC2D10E15 -67.27 2.85 -8.88 -0.26 0
265429 103520238 1 ClNSO2H10C12 ABCD2E10F12 -27.12 2.87 -8.89 -1.18 0
265430 103520240 1 OSN2C8H10 ABC2D8E10 10.66 4.15 -9.06 -0.48 0
265431 103520274 1 SN2O2H12C13 AB2C2D12E13 7.81 5.69 -9.2 -0.73 0
265432 103520280 1 SN2O2C6H8 AB2C2D6E8 -56.03 4.94 -9.22 -0.68 0
265433 103520289 1 ClINOC12H15 ABCDE12F15 -39.97 3.57 -9.02 -0.96 0
265434 103520362 1 BrNO2C14H18 ABC2D14E18 -64.04 2.39 -9.11 -0.02 0
265435 103520563 1 IO2N3H10C11 AB2C3D10E11 2.76 3.77 -9.58 -1.28 0
265436 103520610 1 FN2O2C15H17 AB2C2D15E17 -83.6 5.74 -10.15 -1.06 0
265437 103520612 1 N2O3C15H28 A2B3C15D28 -154.25 3.95 -8.61 1.03 0
265438 103520856 1 SN2O3C14H24 AB2C3D14E24 -129.94 4.37 -8.51 0.35 0
265439 103520942 1 ClNSO4C14H20 ABCD4E14F20 -182.78 4.39 -9.3 -0.65 0
265440 103521161 2 NOSC5H11 ABCD5E11 -104.88 2.4 -8.79 -0.37 0
265441 103521343 1 NSO3C14H23 ABC3D14E23 -141.5 4.27 -8.79 0.04 0
265442 103521354 1 NSO3C14H29 ABC3D14E29 -182.87 5.86 -9.84 0.58 0
265443 103521376 1 NSO3C16H31 ABC3D16E31 -188.07 2.7 -9.57 0.52 0
265444 103521457 1 SN2O2C12H26 AB2C2D12E26 -126.08 5.83 -8.75 0.52 0
265445 103521473 1 SN3O3C13H27 AB3C3D13E27 -144.31 6.69 -8.85 0.14 0
265446 103521561 1 NSO3C16H23 ABC3D16E23 -101.31 3.83 -8.64 -0.17 0
265447 103521682 1 SO2N4C8H18 AB2C4D8E18 -42.09 5.28 -9.78 -0.08 0
265448 103521828 1 BrNSO2C11H24 ABCD2E11F24 -128.48 6.2 -9.65 -0.05 0
265449 103521986 1 FSO2N3C13H20 ABC2D3E13F20 -114.16 6.42 -9.15 -0.56 0