List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
294600 117473172 1 NO6C14H15 AB6C14D15 -146.23 4.62 -8.94 -1.1 0
294601 117473173 1 NO6C14H15 AB6C14D15 -154.93 8.31 -9.03 -0.89 0
294602 117473174 1 NO6C14H15 AB6C14D15 -150.0 5.03 -8.7 -1.18 0
294603 117473226 1 FNO4C15H16 ABC4D15E16 -163.02 2.54 -8.75 -0.55 0
294604 117473265 1 NO5C15H19 AB5C15D19 -216.83 3.87 -8.92 -0.39 0
294605 117473412 1 NO4C16H23 AB4C16D23 -164.17 3.34 -8.85 -0.18 0
294606 117473416 1 NO4C16H23 AB4C16D23 -165.2 3.43 -8.84 -0.04 0
294607 117473471 1 NO4C16H23 AB4C16D23 -156.99 2.22 -8.81 -0.61 0
294608 117473521 1 NSO3C15H19 ABC3D15E19 -87.02 4.05 -8.81 -0.56 0
294609 117473601 1 NO3C17H27 AB3C17D27 -104.3 2.61 -8.62 0.11 0
294610 117473731 1 BrClFO2H7C10 ABCD2E7F10 -96.08 4.19 -9.92 -1.16 0
294611 117473811 1 ClNO4H12C14 ABC4D12E14 -107.57 5.87 -9.37 -1.44 0
294612 117473882 1 ClNOF3C13H15 ABCD3E13F15 -194.53 3.35 -9.26 -0.84 0
294613 117473988 1 ClNO3C15H16 ABC3D15E16 -47.78 4.69 -8.76 -0.48 0
294614 117474000 1 ClNO3C15H16 ABC3D15E16 -82.68 4.34 -9.03 -0.66 0
294615 117474034 1 ClNO2C16H20 ABC2D16E20 -65.79 2.94 -9.05 -0.37 0
294616 117474188 1 ClNOC17H24 ABCD17E24 -70.42 2.82 -8.71 0.02 0
294617 117474197 1 ClNOC17H24 ABCD17E24 -70.59 3.05 -8.67 0.09 0
294618 117474399 1 BrNOF2C11H14 ABCD2E11F14 -112.77 2.05 -9.32 -0.6 0
294619 117474529 1 BrN3C13H16 AB3C13D16 42.14 3.37 -8.67 -0.57 0
294620 117474534 1 BrN3C13H16 AB3C13D16 42.82 5.06 -8.55 -0.31 0
294621 117474535 1 BrN3C13H16 AB3C13D16 42.72 2.74 -8.74 -0.38 0
294622 117474538 1 BrN3C13H16 AB3C13D16 43.77 2.46 -8.67 -0.64 0
294623 117474552 1 BrN3C13H16 AB3C13D16 43.86 3.53 -8.73 -0.5 0
294624 117474674 1 FN2O4C14H15 AB2C4D14E15 -149.58 2.94 -8.57 -0.97 0
294625 117474677 1 FN2O4C14H15 AB2C4D14E15 -146.84 4.34 -8.64 -0.98 0
294626 117474688 1 FN2O4C14H15 AB2C4D14E15 -148.81 8.56 -9.56 -0.68 0
294627 117474823 1 O5C16H22 A5B16C22 -186.0 4.48 -8.91 -0.22 0
294628 117475315 1 ClN2O3C14H15 AB2C3D14E15 -52.69 3.51 -8.78 -0.24 0
294629 117475527 1 ClON2C16H23 ABC2D16E23 -29.31 2.22 -8.88 -0.1 0
294630 117475574 1 BrFO5H8C9 ABC5D8E9 -230.2 2.27 -9.52 -1.04 0
294631 117475612 1 BrF2O3H9C10 AB2C3D9E10 -193.36 3.64 -9.58 -0.87 0
294632 117475874 1 NSF2O4C11H15 ABC2D4E11F15 -236.83 4.2 -9.69 -1.24 0
294633 117475909 1 SN3O4C12H13 AB3C4D12E13 -78.92 2.56 -8.82 -0.71 0
294634 117475976 1 NO5C15H21 AB5C15D21 -184.6 4.53 -8.97 -0.4 0
294635 117475977 1 NO5C15H21 AB5C15D21 -195.67 6.01 -8.14 -0.25 0
294636 117476057 1 NSO4C14H17 ABC4D14E17 -132.15 4.51 -10.02 -0.76 0
294637 117476058 1 NSO4C14H17 ABC4D14E17 -116.79 9.58 -9.47 -0.52 0
294638 117476126 1 FNO2C17H26 ABC2D17E26 -139.63 3.9 -8.4 0.25 0
294639 117476290 1 BrClFO2H9C10 ABCD2E9F10 -128.83 3.4 -10.02 -1.09 0
294640 117477465 1 SN2O5C12H12 AB2C5D12E12 -151.5 8.23 -9.64 -0.79 0
294641 117477648 1 N2O4C15H24 A2B4C15D24 -180.34 4.72 -8.55 -0.06 0
294642 117477694 1 SO4C15H20 AB4C15D20 -163.09 1.99 -8.86 -0.23 0
294643 117477873 1 ClF3O3C12H12 AB3C3D12E12 -288.92 2.63 -9.67 -1.16 0
294644 117478428 1 BrO3C13H13 AB3C13D13 -94.04 3.72 -9.42 -0.72 0
294645 117478554 1 BrO2C14H17 AB2C14D17 -57.44 1.88 -8.93 -0.24 0
294646 117478570 1 BrO2C14H17 AB2C14D17 -76.8 3.69 -9.76 -0.34 0
294647 117478572 1 BrO2C14H17 AB2C14D17 -91.65 4.34 -9.38 -0.2 0
294648 117478587 1 BrO2C14H17 AB2C14D17 -44.49 5.4 -9.05 -0.27 0
294649 117478686 1 BrOC15H21 ABC15D21 -35.66 2.99 -9.4 -0.18 0
294650 117478702 1 BrN2C14H21 AB2C14D21 3.44 2.8 -8.67 0.21 0
294651 117478800 1 FSN3O3C12H12 ABC3D3E12F12 -82.75 6.89 -9.41 -1.08 0
294652 117479066 1 NO2C19H23 AB2C19D23 -55.69 2.31 -8.31 -0.43 0
294653 117479085 1 NO2C19H23 AB2C19D23 -37.06 1.95 -8.1 0.18 0
294654 117479099 1 NO2C19H23 AB2C19D23 -23.05 3.85 -8.5 0.12 0
294655 117479121 1 NSO3C15H23 ABC3D15E23 -128.86 4.95 -9.13 -0.44 0
294656 117479556 1 ClNO2C16H24 ABC2D16E24 -82.04 2.58 -8.77 -0.13 0
294657 117479582 1 ClNO2C16H24 ABC2D16E24 -65.44 1.44 -8.75 -0.11 0
294658 117479750 1 BrNO3C12H12 ABC3D12E12 -71.73 2.92 -9.11 -0.71 0
294659 117479751 1 BrNO3C12H12 ABC3D12E12 -92.16 4.49 -8.98 -0.48 0
294660 117479753 1 BrNO3C12H12 ABC3D12E12 -94.18 3.35 -8.98 -0.45 0
294661 117479754 1 BrNO3C12H12 ABC3D12E12 -91.39 1.33 -9.11 -0.57 0
294662 117479891 1 BrO2N3C11H12 AB2C3D11E12 -11.36 4.37 -8.8 -0.43 0
294663 117479978 1 BrNO2C13H16 ABC2D13E16 -52.89 1.35 -9.01 -0.24 0
294664 117480087 1 BrNO2C13H16 ABC2D13E16 -56.54 4.28 -8.67 -0.29 0
294665 117480112 1 BrNO2C13H16 ABC2D13E16 -34.01 2.76 -8.96 -0.26 0
294666 117480181 1 BrNO2C13H16 ABC2D13E16 -38.15 2.44 -9.5 -0.66 0
294667 117480204 1 BrNO2C13H16 ABC2D13E16 -36.94 3.6 -8.85 -0.24 0
294668 117480306 1 BrNOC14H20 ABCD14E20 -44.4 3.0 -8.74 -0.04 0
294669 117480307 1 BrNOC14H20 ABCD14E20 -30.28 2.98 -9.02 -0.19 0
294670 117480324 1 BrNOC14H20 ABCD14E20 -47.53 2.16 -8.86 0.04 0
294671 117480326 1 BrNOC14H20 ABCD14E20 -39.9 3.69 -8.76 -0.01 0
294672 117480342 1 BrNOC14H20 ABCD14E20 -40.1 1.58 -8.96 -0.02 0
294673 117480459 1 BrNOC14H20 ABCD14E20 -27.26 0.63 -9.32 -0.31 0
294674 117480506 1 BrNOC14H20 ABCD14E20 -27.77 3.51 -9.06 -0.02 0
294675 117480560 1 BrNOC14H20 ABCD14E20 -49.76 4.74 -8.74 -0.1 0
294676 117480798 1 FO5C15H19 AB5C15D19 -237.72 4.69 -8.88 -0.47 0
294677 117480822 1 F2N2O2C15H20 A2B2C2D15E20 -156.91 4.75 -8.68 -0.04 0
294678 117480903 1 SO5C14H18 AB5C14D18 -193.45 7.64 -8.75 -0.51 0
294679 117480928 1 SN2O4C13H18 AB2C4D13E18 -148.39 4.02 -8.81 0.01 0
294680 117480933 1 SN2O2H14C16 AB2C2D14E16 -17.19 6.23 -9.49 -1.35 0
294681 117480934 1 SN2O2H14C16 AB2C2D14E16 -23.82 2.18 -9.18 -0.96 0
294682 117480956 2 NOC9H11 ABC9D11 -10.82 5.19 -8.52 -0.78 0
294683 117481025 1 ClF3O4H10C11 AB3C4D10E11 -327.43 3.44 -10.0 -1.38 0
294684 117481026 1 ClF3O4H10C11 AB3C4D10E11 -331.38 3.55 -9.66 -0.97 0
294685 117481059 1 ClFSO5C10H12 ABCD5E10F12 -223.37 5.2 -8.8 -1.05 0
294686 117481070 1 ClO5C14H15 AB5C14D15 -153.3 4.55 -9.08 -1.18 0
294687 117481271 1 ClO4C15H19 AB4C15D19 -178.5 1.62 -9.7 -0.54 0
294688 117481274 1 ClO4C15H19 AB4C15D19 -180.64 4.15 -9.02 -0.25 0
294689 117481505 1 BrO4H11C12 AB4C11D12 -103.0 1.34 -9.44 -1.88 0
294690 117481835 1 BrO3C13H15 AB3C13D15 -111.54 6.63 -9.24 -0.54 0
294691 117482169 1 FNSO4C13H14 ABCD4E13F14 -180.47 3.49 -9.78 -1.14 0
294692 117482171 1 FSN3O3C12H14 ABC3D3E12F14 -102.54 7.71 -8.94 -0.86 0
294693 117483005 1 BrNO3C12H14 ABC3D12E14 -86.01 3.24 -8.84 -0.36 0
294694 117483117 1 BrNO3C12H14 ABC3D12E14 -63.84 5.54 -9.3 -1.1 0
294695 117483371 1 BrNO2C13H18 ABC2D13E18 -50.09 5.0 -8.65 -0.1 0
294696 117483594 1 BrNO2C13H18 ABC2D13E18 -68.13 1.32 -8.43 -0.14 0
294697 117483716 1 BrNO2C13H18 ABC2D13E18 -36.99 4.03 -8.71 -0.19 0
294698 117483873 1 BrFNC14H19 ABCD14E19 -38.48 1.76 -9.43 -0.31 0
294699 117483874 1 BrFNC14H19 ABCD14E19 -38.61 1.83 -9.46 -0.3 0