List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
281000 103852361 1 O2F3N3C8H8 A2B3C3D8E8 -193.03 2.61 -10.58 -1.45 0
281001 103852362 1 O2N3C10H13 A2B3C10D13 -41.58 7.31 -9.9 -0.95 0
281002 103852367 1 SO2N3C10H15 AB2C3D10E15 -41.08 5.84 -9.16 -1.1 0
281003 103852374 1 FNO3C13H18 ABC3D13E18 -184.97 2.27 -9.32 -0.96 0
281004 103852375 1 ClN2O3C15H21 AB2C3D15E21 -142.43 2.91 -9.84 -0.91 0
281005 103852376 1 N3O3C13H27 A3B3C13D27 -184.74 5.34 -9.76 0.64 0
281006 103852377 1 O2N3C16H21 A2B3C16D21 -67.3 5.64 -8.93 -0.93 0
281007 103852381 1 N2O3C11H20 A2B3C11D20 -162.27 2.18 -10.08 0.64 0
281008 103852382 1 N2O3C16H24 A2B3C16D24 -141.88 2.96 -9.57 -0.23 0
281009 103852384 1 N2O3C12H18 A2B3C12D18 -128.08 2.58 -9.5 -0.92 0
281010 103852387 1 ClN2O3C15H21 AB2C3D15E21 -145.25 4.33 -9.98 -1.07 0
281011 103852388 1 N3O3C13H27 A3B3C13D27 -182.96 6.41 -9.64 0.67 0
281012 103852390 1 NO4C15H23 AB4C15D23 -168.15 0.99 -9.21 -0.34 0
281013 103852397 1 NO3C14H21 AB3C14D21 -146.4 5.0 -9.33 -0.14 0
281014 103852399 1 BrN2O3C15H21 AB2C3D15E21 -137.18 6.32 -9.8 -1.01 0
281015 103852405 1 N3O3C13H17 A3B3C13D17 -88.28 6.54 -9.96 -1.07 0
281016 103852419 1 N2O4C13H14 A2B4C13D14 -60.02 7.15 -9.85 -1.53 0
281017 103852421 1 N2O4C13H14 A2B4C13D14 -67.63 4.46 -9.61 -1.66 0
281018 103852423 1 FNO2C13H14 ABC2D13E14 -111.57 5.93 -9.35 -0.61 0
281019 103852426 1 FNO2C13H16 ABC2D13E16 -128.2 4.95 -9.49 -0.7 0
281020 103852427 1 N2O4C15H26 A2B4C15D26 -224.19 4.14 -9.99 0.45 0
281021 103852434 1 NO2C11H15 AB2C11D15 -72.2 0.99 -8.88 0.14 0
281022 103852438 1 OC13H16 AB13C16 -40.09 4.3 -9.51 -0.47 0
281023 103852441 1 ClNO2C9H10 ABC2D9E10 -74.69 5.75 -9.62 -1.01 0
281024 103852442 1 BrNF2C10H12 ABC2D10E12 -80.25 2.45 -9.76 -0.84 0
281025 103852443 1 NOC13H21 ABC13D21 -53.73 3.21 -8.68 0.29 0
281026 103852445 1 SN2O4C12H14 AB2C4D12E14 -69.39 8.61 -9.15 -1.53 0
281027 103852451 1 ClOSC9H9 ABCD9E9 -28.66 3.53 -9.21 -0.54 0
281028 103852456 1 BrClNC11H15 ABCD11E15 -7.41 0.99 -9.53 -0.58 0
281029 103852462 1 NF4C13H17 AB4C13D17 -215.12 3.64 -9.76 -0.96 0
281030 103852464 1 N3C9H17 A3B9C17 1.71 3.76 -9.31 0.59 0
281031 103852469 1 NF2C13H19 AB2C13D19 -103.24 2.83 -9.35 -0.03 0
281032 103852488 1 BrClNC10H11 ABCD10E11 29.31 0.3 -9.75 -0.63 0
281033 103852489 1 BrClNC9H9 ABCD9E9 31.55 0.32 -9.76 -0.66 0
281034 103852490 1 BrClNC11H13 ABCD11E13 23.05 0.46 -9.77 -0.6 0
281035 103852491 1 BrClNC10H11 ABCD10E11 25.4 0.53 -9.77 -0.61 0
281036 103852493 1 BrClNC11H15 ABCD11E15 -8.46 1.04 -9.64 -0.57 0
281037 103852505 1 BrNF2C11H14 ABC2D11E14 -86.15 2.57 -9.64 -0.79 0
281038 103852520 1 NOBr2C9H11 ABC2D9E11 -17.88 2.01 -9.38 -0.56 0
281039 103852521 1 NBr2C11H15 AB2C11D15 1.9 1.4 -9.13 -0.57 0
281040 103852525 1 NC12H19 AB12C19 -8.42 2.22 -9.18 0.43 0
281041 103852528 1 NC13H19 AB13C19 -6.17 2.56 -9.07 0.51 0
281042 103852550 1 FNC13H18 ABC13D18 -53.14 2.33 -9.15 0.15 0
281043 103852558 1 ClNC12H16 ABC12D16 -11.12 2.22 -9.19 -0.01 0
281044 103852559 1 ON2C11H16 AB2C11D16 -19.61 5.16 -9.01 -0.12 0
281045 103852569 1 BrFNC11H13 ABCD11E13 -31.91 4.37 -9.45 -0.35 0
281046 103852579 1 FO2C12H13 AB2C12D13 -113.99 3.2 -8.98 -0.06 0
281047 103852580 1 FO2C13H15 AB2C13D15 -116.81 4.27 -9.06 -0.17 0
281048 103852586 1 BrFOH10C11 ABCD10E11 -67.93 3.13 -9.78 -0.43 0
281049 103852597 1 ClO2N3C17H24 AB2C3D17E24 -101.2 5.55 -9.2 -0.33 0
281050 103852605 1 ClO2N3C16H24 AB2C3D16E24 -104.35 7.37 -8.57 -0.26 0
281051 103852606 1 ClO2N3C16H24 AB2C3D16E24 -109.21 4.91 -8.66 -0.33 0
281052 103852608 1 ClO2N3C17H26 AB2C3D17E26 -110.71 5.03 -8.7 -0.36 0
281053 103852618 1 BrNOC11H14 ABCD11E14 -45.87 4.25 -9.51 -0.51 0
281054 103852627 1 BrNOH16C17 ABCD16E17 -3.62 5.34 -8.55 -0.51 0
281055 103852638 1 NO4C13H23 AB4C13D23 -199.0 8.05 -10.36 0.51 0
281056 103852645 1 BrNOC16H16 ABCD16E16 -2.18 4.57 -9.25 -0.45 0
281057 103852647 1 BrNO2C13H16 ABC2D13E16 -79.06 5.47 -9.41 -0.63 0
281058 103852648 1 BrON2C15H21 ABC2D15E21 -34.05 3.14 -8.72 -0.44 0
281059 103852658 1 BrNOC16H16 ABCD16E16 -20.66 3.32 -8.41 -0.67 0
281060 103852665 1 BrNO2H14C15 ABC2D14E15 -41.41 5.44 -8.24 -0.7 0
281061 103852670 1 BrINOH11C14 ABCDE11F14 14.14 3.36 -8.89 -0.96 0
281062 103852690 1 BrON2H13C14 ABC2D13E14 5.37 4.15 -9.62 -0.7 0
281063 103852700 1 BrNOC13H18 ABCD13E18 -52.64 4.26 -9.38 -0.51 0
281064 103852706 1 BrNO3C14H20 ABC3D14E20 -112.79 3.52 -9.1 -0.56 0
281065 103852709 1 BrN2O3C15H19 AB2C3D15E19 -119.77 2.41 -9.33 -0.57 0
281066 103852711 1 BrNOC18H20 ABCD18E20 -22.61 4.4 -9.09 -0.58 0
281067 103852720 1 BrNO2C16H16 ABC2D16E16 -45.78 5.05 -8.85 -0.54 0
281068 103852727 1 BrNO2C16H16 ABC2D16E16 -50.01 4.18 -8.22 -0.59 0
281069 103852728 1 BrNO3C16H20 ABC3D16E20 -131.12 5.56 -9.21 -0.46 0
281070 103852731 1 BrFNOH13C15 ABCDE13F15 -59.03 5.65 -8.74 -0.81 0
281071 103852733 1 BrNO2C14H18 ABC2D14E18 -96.71 4.04 -9.56 -0.61 0
281072 103852764 1 BrNOC15H20 ABCD15E20 -57.16 4.26 -9.38 -0.49 0
281073 103852779 1 BrNO2C17H18 ABC2D17E18 -38.96 6.03 -8.78 -0.36 0
281074 103852780 1 BrNO2C17H18 ABC2D17E18 -42.54 5.22 -8.98 -0.46 0
281075 103852792 1 ON2F3C14H15 AB2C3D14E15 -171.87 3.07 -9.59 -0.15 0
281076 103852794 1 BrON3C16H20 ABC3D16E20 -9.3 5.05 -9.08 -0.72 0
281077 103852799 1 BrFNOH15C16 ABCDE15F16 -49.81 4.07 -9.37 -0.49 0
281078 103852803 1 BrNO3C15H20 ABC3D15E20 -138.0 2.39 -9.62 -0.62 0
281079 103852805 1 ON3C10H21 AB3C10D21 -24.54 2.13 -8.96 1.0 0
281080 103852820 1 NOC15H23 ABC15D23 -18.89 0.64 -8.88 0.32 0
281081 103852821 1 NO2C15H23 AB2C15D23 -63.62 2.44 -9.31 0.37 0
281082 103852828 1 NF2O2C15H21 AB2C2D15E21 -163.04 4.21 -9.15 -0.1 0
281083 103852835 1 N3O3C11H21 A3B3C11D21 -131.51 3.22 -9.75 0.33 0
281084 103852836 1 N2O2C15H28 A2B2C15D28 -96.22 4.32 -9.16 1.09 0
281085 103852848 1 N3O3C10H19 A3B3C10D19 -131.48 3.95 -9.81 0.22 0
281086 103852851 1 N2O3C14H20 A2B3C14D20 -18.88 5.21 -9.16 -1.29 0
281087 103852854 1 ClNOC14H20 ABCD14E20 -25.13 2.26 -9.07 -0.12 0
281088 103852859 2 NOC6H12 ABC6D12 -95.21 4.66 -9.43 1.04 0
281089 103852875 1 BrNOC15H20 ABCD15E20 -12.73 2.07 -9.22 -0.17 0
281090 103852894 1 BrNO2C17H18 ABC2D17E18 -39.5 4.66 -9.38 -0.65 0
281091 103852920 1 BrN2O2C13H17 AB2C2D13E17 -87.35 1.76 -9.5 -0.53 0
281092 103852921 1 BrNOC13H16 ABCD13E16 -23.73 4.02 -9.51 -0.52 0
281093 103852926 1 BrON2H13C16 ABC2D13E16 23.45 7.54 -8.89 -0.86 0
281094 103852936 1 BrON3H12C15 ABC3D12E15 49.21 4.54 -8.41 -0.76 0
281095 103852949 1 BrNO2H14C15 ABC2D14E15 -5.7 4.36 -9.29 -0.77 0
281096 103852952 1 BrN2O2C12H15 AB2C2D12E15 -82.24 4.86 -9.64 -0.83 0
281097 103852953 1 BrN2O2C13H17 AB2C2D13E17 -86.92 4.27 -9.6 -0.8 0
281098 103904167 1 NO2C17H23 AB2C17D23 -28.81 2.03 -8.56 0.21 0
281099 103905689 1 NO2C13H23 AB2C13D23 -58.59 3.35 -9.23 1.86 0