List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
261400 103230838 1 NO2C10H17 AB2C10D17 -92.42 7.07 -9.85 -0.06 0
261401 103230841 1 NO2C11H19 AB2C11D19 -103.71 3.98 -9.16 0.59 0
261402 103230980 1 NO3C10H21 AB3C10D21 -148.38 1.82 -9.08 0.71 0
261403 103231075 1 NO3C12H17 AB3C12D17 -114.93 6.45 -9.38 -0.65 0
261404 103231091 1 NSO2C12H17 ABC2D12E17 -80.5 7.67 -9.26 -0.98 0
261405 103231166 1 NO2C8H13 AB2C8D13 -65.05 4.8 -9.0 0.19 0
261406 103231278 1 O2N4C15H22 A2B4C15D22 -53.94 7.53 -9.54 -0.72 0
261407 103231281 1 NSO2C16H21 ABC2D16E21 -83.63 7.01 -9.3 -1.21 0
261408 103231282 1 NO2C15H23 AB2C15D23 -111.23 6.66 -9.31 -0.14 0
261409 103231387 1 NSO4C13H17 ABC4D13E17 -158.2 5.3 -9.96 -0.51 0
261410 103231412 1 NCl2O2C11H11 AB2C2D11E11 -72.46 5.55 -8.58 -0.66 0
261411 103231502 1 ClNO2C12H14 ABC2D12E14 -65.87 5.27 -9.05 -0.41 0
261412 103231852 1 O2N3C11H17 A2B3C11D17 -62.97 5.92 -9.09 -0.06 0
261413 103231964 1 FO2N3C14H14 AB2C3D14E14 -69.32 4.22 -9.85 -1.4 0
261414 103232212 1 ClO2N3H12C13 AB2C3D12E13 -29.97 3.84 -9.21 -1.77 0
261415 103232310 1 BrNO2C11H12 ABC2D11E12 -58.38 3.39 -8.83 -0.8 0
261416 103232312 1 BrN2O3H11C12 AB2C3D11E12 -36.12 2.86 -8.88 -1.35 0
261417 103232332 1 O2N5C12H23 A2B5C12D23 -39.57 7.21 -8.76 -0.74 0
261418 103232526 1 NSO2C15H15 ABC2D15E15 -35.46 4.31 -8.46 -0.9 0
261419 103232542 1 SN2O3C15H20 AB2C3D15E20 -112.38 4.55 -8.55 -0.14 0
261420 103232794 1 NF3O3C12H12 AB3C3D12E12 -244.47 5.44 -9.05 -0.61 0
261421 103232921 1 BrNO2C13H16 ABC2D13E16 -63.45 4.18 -8.5 -0.37 0
261422 103232949 1 ClON3C10H14 ABC3D10E14 -28.59 3.49 -9.33 -0.06 0
261423 103233114 1 NO2C14H25 AB2C14D25 -102.43 0.94 -9.06 0.03 0
261424 103233117 1 NO3C12H23 AB3C12D23 -167.74 5.01 -9.4 0.45 0
261425 103233337 2 NOC6H9 ABC6D9 -77.99 2.53 -8.46 0.08 0
261426 103233402 1 FNO3C15H16 ABC3D15E16 -127.07 6.98 -9.5 -0.67 0
261427 103233418 1 FNSO2C15H16 ABCD2E15F16 -93.51 6.63 -9.45 -1.01 0
261428 103233443 1 N2O2C15H30 A2B2C15D30 -132.2 7.03 -8.8 0.95 0
261429 103233471 2 NOC7H10 ABC7D10 -57.37 6.88 -9.2 -0.05 0
261430 103233600 1 NO3C15H15 AB3C15D15 -77.55 4.13 -8.35 -0.5 0
261431 103233715 1 NO4C15H17 AB4C15D17 -121.62 5.77 -8.34 -0.73 0
261432 103233784 1 NCl2O3C14H19 AB2C3D14E19 -136.01 2.7 -9.22 -0.42 0
261433 103233903 1 N2O4C15H16 A2B4C15D16 -128.44 7.93 -8.66 -0.75 0
261434 103233972 1 NCl2O3C14H17 AB2C3D14E17 -136.67 4.34 -9.56 -0.56 0
261435 103234053 1 NF2O2H9C10 AB2C2D9E10 -143.4 1.55 -9.14 -0.98 0
261436 103234132 1 ON3C11H17 AB3C11D17 -28.44 4.16 -9.57 0.19 0
261437 103234133 1 N2O3C14H20 A2B3C14D20 -117.54 4.88 -9.04 0.25 0
261438 103234157 1 NSO2C14H15 ABC2D14E15 -47.88 4.08 -8.28 -1.23 0
261439 103234175 1 NO2C18H21 AB2C18D21 -64.5 5.76 -8.2 -0.44 0
261440 103234195 1 ClNO2C12H14 ABC2D12E14 -70.36 5.88 -8.54 -0.57 0
261441 103234232 1 FNO2C13H16 ABC2D13E16 -107.53 4.83 -8.53 -0.31 0
261442 103234265 1 ClO2N4C11H11 AB2C4D11E11 -8.46 5.56 -8.95 -0.92 0
261443 103234269 1 ClNSO2H10C12 ABCD2E10F12 -39.12 2.58 -8.8 -1.58 0
261444 103234373 1 NBr2O2C10H11 AB2C2D10E11 -69.05 2.99 -8.31 -0.88 0
261445 103234393 1 BrNO2F3H9C10 ABC2D3E9F10 -225.32 3.93 -8.98 -0.36 0
261446 103234453 1 BrO2N4C11H11 AB2C4D11E11 2.58 7.28 -9.14 -0.88 0
261447 103234501 1 FNO2C11H12 ABC2D11E12 -104.34 4.77 -8.71 -0.55 0
261448 103234527 1 ClNO3C12H16 ABC3D12E16 -121.14 3.54 -8.51 0.05 0
261449 103234555 1 ClN2O3C12H15 AB2C3D12E15 -123.65 2.73 -8.58 0.06 0
261450 103234563 1 ClNSO2H12C13 ABCD2E12F13 -48.84 6.86 -8.66 -1.33 0
261451 103234565 1 ClNO2C16H16 ABC2D16E16 -56.36 5.15 -8.62 -0.54 0
261452 103234592 1 N2O2C11H22 A2B2C11D22 -98.01 5.52 -8.87 0.26 0
261453 103234593 1 N2O2F3C11H21 A2B2C3D11E21 -265.93 4.73 -8.79 -0.01 0
261454 103234658 1 NO3C13H19 AB3C13D19 -113.09 6.87 -9.29 -0.52 0
261455 103234668 1 NO4C15H19 AB4C15D19 -133.98 3.83 -9.39 -0.94 0
261456 103234691 1 NO2C13H25 AB2C13D25 -129.6 4.55 -8.93 0.6 0
261457 103234832 1 O2N3C13H13 A2B3C13D13 -21.73 3.75 -8.44 -1.71 0
261458 103234890 1 NO2C11H13 AB2C11D13 -69.92 7.18 -8.84 -0.57 0
261459 103234893 1 NO2C14H19 AB2C14D19 -69.83 2.81 -8.13 -0.27 0
261460 103234908 1 NO3C14H19 AB3C14D19 -97.79 2.27 -7.93 -0.19 0
261461 103234961 1 BrNO3C11H14 ABC3D11E14 -115.02 2.86 -9.65 -0.36 0
261462 103234970 1 NO3C16H17 AB3C16D17 -83.37 7.73 -8.71 -0.83 0
261463 103234986 1 NO3H15C17 AB3C15D17 -58.61 5.09 -8.68 -1.06 0
261464 103235071 1 NO4C11H11 AB4C11D11 -108.95 5.6 -8.67 -0.58 0
261465 103235114 1 NO4H13C15 AB4C13D15 -80.51 6.2 -9.21 -1.37 0
261466 103235164 1 NO3C13H19 AB3C13D19 -123.71 6.27 -9.37 -0.75 0
261467 103235175 1 NO2C13H19 AB2C13D19 -91.41 5.84 -9.18 -0.27 0
261468 103235190 1 NO2C9H17 AB2C9D17 -102.63 4.29 -9.32 0.5 0
261469 103235236 1 N2O3C10H12 A2B3C10D12 -107.88 4.23 -9.97 -0.49 0
261470 103235263 1 N2O2C9H18 A2B2C9D18 -82.79 6.06 -9.0 -0.2 0
261471 103235287 1 N2O3C12H20 A2B3C12D20 -94.98 3.34 -8.89 -0.47 0
261472 103235335 1 NF3O3C6H10 AB3C3D6E10 -302.27 2.64 -10.11 0.13 0
261473 103235374 1 O2N5C12H19 A2B5C12D19 -26.85 7.98 -9.07 -0.76 0
261474 103235379 2 NOC7H12 ABC7D12 -86.07 1.78 -8.9 -0.06 0