List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
285025 104091250 1 NO2C12H21 AB2C12D21 -57.33 2.28 -8.67 1.71 0
285026 104091273 1 ON3C8H11 AB3C8D11 40.46 2.34 -10.48 -0.14 0
285027 104091710 1 BrNSC13H18 ABCD13E18 58.9 1.23 -9.28 -0.59 0
285028 104091711 1 NOC10H19 ABC10D19 -32.19 2.14 -9.4 1.77 0
285029 104091801 2 N2C5H8 A2B5C8 72.77 4.03 -9.66 0.15 0
285030 104091802 1 N4C11H18 A4B11C18 79.42 2.7 -9.6 0.18 0
285031 104091932 2 NC8H15 AB8C15 16.51 2.11 -8.38 1.91 0
285032 104092004 1 NC13H25 AB13C25 -8.06 2.64 -8.77 1.97 0
285033 104092005 1 NO2C9H17 AB2C9D17 -60.87 2.49 -9.59 1.72 0
285034 104092006 1 NO2C10H19 AB2C10D19 -60.89 0.9 -9.08 1.67 0
285035 104092307 1 NOC11H13 ABC11D13 18.24 4.81 -9.36 -0.43 0
285036 104092308 1 NO2C11H13 AB2C11D13 -16.69 2.97 -9.31 -0.4 0
285037 104092427 2 OC7H8 AB7C8 -44.52 3.4 -8.44 0.08 0
285038 104092567 1 NO3C14H17 AB3C14D17 -39.39 1.7 -8.29 -0.11 0
285039 104092610 1 ClNSO2H12C13 ABCD2E12F13 -16.13 9.43 -9.53 -0.93 0
285040 104092708 1 OSC12H14 ABC12D14 29.96 1.64 -8.7 -0.18 0
285041 104092711 2 BrOC6H6 ABC6D6 -12.56 1.1 -8.61 -0.63 0
285042 104092712 1 NO3C12H13 AB3C12D13 22.35 7.07 -9.53 -1.12 0
285043 104092714 1 N2O2C11H16 A2B2C11D16 -33.23 6.85 -9.64 0.07 0
285044 104092725 1 NO2C14H15 AB2C14D15 -11.53 1.63 -8.66 -0.3 0
285045 104092925 1 ON3C15H19 AB3C15D19 10.27 3.09 -9.41 -0.48 0
285046 104092927 1 ON4C14H14 AB4C14D14 58.49 4.43 -9.5 -1.27 0
285047 104093117 1 O3N4C14H16 A3B4C14D16 -41.86 4.73 -9.4 -0.67 0
285048 104093123 1 SO2N4C14H18 AB2C4D14E18 -11.16 4.87 -9.36 -0.49 0
285049 104093182 1 ON3C16H23 AB3C16D23 0.08 5.83 -9.54 -0.1 0
285050 104093447 1 O2N5C12H19 A2B5C12D19 8.39 4.67 -10.02 -0.81 0
285051 104093453 1 O2N4C11H20 A2B4C11D20 -66.62 6.15 -9.88 0.1 0
285052 104093474 1 O2N3C15H19 A2B3C15D19 -22.06 3.76 -8.85 -0.06 0
285053 104093622 1 O4N5C11H19 A4B5C11D19 -129.26 3.8 -10.1 -0.56 0
285054 104093752 1 BrCl2N3H10C11 AB2C3D10E11 59.15 2.95 -9.78 -1.27 0
285055 104093755 1 BrClN3C12H13 ABC3D12E13 54.99 2.91 -9.45 -0.92 0
285056 104093759 1 BrClF3N3H10C12 ABC3D3E10F12 -92.53 4.09 -9.84 -1.6 0
285057 104094067 1 ClN6C9H13 AB6C9D13 85.32 2.26 -10.2 -0.48 0
285058 104094068 1 ClON4C13H17 ABC4D13E17 12.75 2.49 -9.83 -0.44 0
285059 104094073 1 ClO3N4C13H15 AB3C4D13E15 18.68 7.51 -10.04 -1.42 0
285060 104094303 1 BrNO2C12H12 ABC2D12E12 -10.34 5.25 -9.63 -0.78 0
285061 104094332 1 SN5C9H15 AB5C9D15 122.97 5.33 -9.34 -0.56 0
285062 104094498 4 NC3H5 AB3C5 62.43 3.85 -8.75 0.32 0
285063 104094637 1 SO2C10H14 AB2C10D14 -69.73 5.08 -9.48 -0.26 0
285064 104094638 1 NOC12H21 ABC12D21 -27.83 2.04 -9.05 1.84 0
285065 104095016 1 NO4C11H13 AB4C11D13 -153.6 1.91 -9.39 -0.99 0
285066 104095152 1 NO4C12H23 AB4C12D23 -212.36 4.56 -9.82 0.54 0
285067 104095343 1 SN2O2C7H14 AB2C2D7E14 -83.01 4.21 -8.66 -0.37 0
285068 104095449 1 OSN3C6H11 ABC3D6E11 -4.39 4.9 -8.46 -0.12 0
285069 104095628 2 NOC6H13 ABC6D13 -115.09 5.69 -9.12 1.22 0
285070 104095629 2 NOC4H8 ABC4D8 -98.2 3.65 -9.25 0.87 0
285071 104095630 2 NOC4H8 ABC4D8 -98.23 1.47 -9.3 0.94 0
285072 104095631 2 NOC6H12 ABC6D12 -115.79 3.38 -9.14 1.09 0
285073 104095839 1 O2N3C8H15 A2B3C8D15 -33.19 2.91 -9.56 -0.34 0
285074 104096050 1 NO2C13H19 AB2C13D19 -88.29 3.48 -9.28 0.22 0
285075 104096574 1 BrNO2C9H12 ABC2D9E12 -70.83 3.55 -8.98 -0.5 0
285076 104096605 1 NO5C11H13 AB5C11D13 -93.22 4.01 -9.91 -1.84 0
285077 104096609 1 N3O3C8H13 A3B3C8D13 -76.73 6.32 -10.26 -0.01 0
285078 104096642 1 NO5C15H21 AB5C15D21 -200.29 5.2 -8.81 -0.04 0
285079 104096654 1 ClFNO4H9C14 ABCD4E9F14 -74.09 2.44 -9.79 -1.82 0
285080 104096721 4 NC4H6 AB4C6 53.36 5.02 -9.22 0.19 0
285081 104096936 1 SN2O4C12H14 AB2C4D12E14 -59.18 4.45 -8.83 -1.57 0
285082 104097057 1 N2O5C13H18 A2B5C13D18 -137.08 8.41 -8.98 -1.41 0
285083 104097115 1 SO2C6H14 AB2C6D14 -103.73 2.62 -8.94 0.34 0
285084 104097126 1 N3O3C11H15 A3B3C11D15 -78.8 4.0 -9.44 -1.06 0
285085 104097156 1 N3O3C11H17 A3B3C11D17 -98.21 1.95 -9.2 -0.97 0
285086 104097157 1 N2O5C14H20 A2B5C14D20 -142.29 8.28 -8.97 -1.4 0
285087 104097220 1 N3O3C14H21 A3B3C14D21 -89.48 4.73 -9.05 -0.82 0
285088 104097226 1 N2F3O3H11C12 A2B3C3D11E12 -165.09 4.9 -9.28 -1.45 0
285089 104097231 1 N2O5C13H18 A2B5C13D18 -134.83 5.85 -9.26 -1.66 0
285090 104097288 1 BrNO2C9H12 ABC2D9E12 -61.24 3.24 -9.31 -0.59 0
285091 104097414 1 SN2O2C10H16 AB2C2D10E16 -0.22 6.63 -9.52 -1.56 0
285092 104097727 1 SO2N3C13H19 AB2C3D13E19 14.73 8.17 -8.88 -1.47 0
285093 104097728 1 ClSN2O2C14H15 ABC2D2E14F15 23.58 7.65 -9.5 -1.59 0
285094 104097735 1 SN3O3C14H17 AB3C3D14E17 -1.94 6.98 -9.34 -1.48 0
285095 104097827 1 SN2O4C14H14 AB2C4D14E14 -29.04 7.09 -8.43 -1.66 0
285096 104097828 1 SN2O2C14H16 AB2C2D14E16 28.46 4.86 -8.64 -1.79 0
285097 104097872 1 SN3O3C9H13 AB3C3D9E13 -27.67 8.01 -9.39 -1.5 0
285098 104097887 1 N2O4C15H18 A2B4C15D18 -41.83 6.71 -9.08 -1.53 0
285099 104097911 1 SN2O2C14H14 AB2C2D14E14 64.48 6.02 -9.54 -1.64 0