List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
12973 219403 1 N2O2C9H10 A2B2C9D10 -26.28 3.99 -8.76 -0.48 0
12974 219444 2 OH6C7 AB6C7 -38.06 3.43 -9.25 -0.67 0
12975 219445 1 ClBr2C27H45 AB2C27D45 -96.62 5.97 -9.61 -0.39 0
12976 219451 1 ClNOH10C14 ABCD10E14 31.57 3.97 -9.78 -1.22 0
12977 219456 1 O2C21H44 A2B21C44 -186.79 4.02 -10.26 2.6 0
12978 219458 2 NC5H10 AB5C10 -17.78 3.22 -8.42 2.74 0
12979 219459 1 O3C14H18 A3B14C18 -127.52 2.44 -9.51 0.12 0
12980 219460 1 O4C9H18 A4B9C18 -196.98 1.87 -10.01 0.77 0
12981 219461 2 SC2H4 AB2C4 -10.52 3.56 -8.3 -0.98 0
12982 219462 1 O3C16H34 A3B16C34 -204.24 2.64 -10.07 1.68 0
12983 219463 2 O2C5H8 A2B5C8 -202.95 3.61 -10.95 0.33 0
12984 219467 6 OC3H4 AB3C4 -268.1 1.59 -9.66 0.1 0
12985 219498 1 OC8H16 AB8C16 -79.06 2.98 -9.82 0.87 0
12986 219500 1 OC10H20 AB10C20 -81.91 3.14 -9.37 0.79 0
12987 219726 1 O8H22C27 A8B22C27 -150.02 8.56 -10.24 -0.94 0
12988 219727 2 O3C4H7 A3B4C7 -257.48 2.52 -10.37 0.67 0
12989 219728 1 O5C9H14 A5B9C14 -112.9 2.6 -10.34 0.46 0
12990 219733 1 BrN4H7C10 AB4C7D10 106.7 4.48 -9.54 -1.12 0
12991 219740 1 N4C5H6 A4B5C6 73.86 5.81 -9.48 -0.14 0
12992 219741 1 ON4C7H8 AB4C7D8 24.29 5.25 -9.78 -0.46 0
12993 219852 1 ON4C6H8 AB4C6D8 25.35 4.71 -9.5 -0.26 0
12994 219853 1 O3N4C10H12 A3B4C10D12 -67.59 8.57 -9.66 -0.28 0
12995 219854 1 N5C6H7 A5B6C7 73.75 8.05 -9.05 -0.67 0
12996 219855 1 SN4C7H8 AB4C7D8 71.63 1.69 -9.21 -0.9 0
12997 219875 2 N3C5H8 A3B5C8 76.4 2.55 -8.32 -0.02 0
12998 219878 2 ON3C8H9 AB3C8D9 71.54 10.73 -9.15 -1.46 0
12999 219898 1 O15C24H32 A15B24C32 -666.21 4.05 -9.53 0.32 0
13000 219903 1 NC6O6H13 AB6C6D13 -283.54 3.26 -10.64 0.45 0
13001 219919 1 BrNOC10H20 ABCD10E20 -89.36 1.98 -9.96 -0.63 0
13002 219920 1 NOCl2C6H11 ABC2D6E11 -77.71 2.87 -10.26 -0.47 0
13003 219922 1 NO4C9H9 AB4C9D9 -26.53 5.87 -9.84 -1.29 0
13004 219933 2 O15C22H30 A15B22C30 -1375.93 7.32 -10.48 0.27 0
13005 219938 1 O2H10C15 A2B10C15 -20.12 3.59 -8.8 -1.2 0
13006 219940 1 NO2C20H23 AB2C20D23 -52.21 3.43 -8.51 -0.55 0
13007 219944 1 O3H14C18 A3B14C18 -75.72 2.03 -8.88 -1.03 0
13008 219945 2 O2C5H7 A2B5C7 -183.21 2.47 -10.08 0.08 0
13009 219947 1 Br2O6H12C13 A2B6C12D13 -235.25 4.68 -9.77 -0.99 0
13010 219960 1 O3H14C16 A3B14C16 -76.27 3.13 -9.53 -0.86 0
13011 219962 1 NOH11C17 ABC11D17 33.69 2.79 -8.66 -0.86 0
13012 219970 1 NOC18H19 ABC18D19 6.21 3.33 -8.64 -0.5 0
13013 219971 1 NSO2H11C14 ABC2D11E14 -14.01 4.03 -8.44 -0.54 0
13014 219973 1 NO8C12H15 AB8C12D15 -247.12 7.21 -10.1 -1.48 0
13015 219976 1 N2O7C13H20 A2B7C13D20 -273.77 3.71 -8.96 -0.1 0
13016 219984 1 O5C6H12 A5B6C12 -231.81 1.21 -10.44 1.02 0
13017 219993 2 O8C9H16 A8B9C16 -724.27 2.91 -10.46 0.13 0
13018 219994 1 O11C12H22 A11B12C22 -490.65 4.32 -10.36 -0.48 0
13019 219995 1 ClOSH7C9 ABCD7E9 -19.55 2.64 -8.51 -0.83 0
13020 220003 2 O8C9H16 A8B9C16 -724.23 6.68 -10.55 -0.13 0
13021 220013 2 OC6H11 AB6C11 -135.45 4.89 -10.7 0.65 0
13022 220018 1 O5C23H42 A5B23C42 -289.8 2.26 -9.73 0.6 0
13023 220027 1 NSC10H11 ABC10D11 44.8 3.29 -9.02 -0.18 0
13024 220028 1 SO4C14H18 AB4C14D18 -163.03 4.37 -9.06 -0.5 0
13025 220032 1 NSC10H11 ABC10D11 39.25 4.27 -8.93 -0.35 0
13026 220039 2 OC6H10 AB6C10 -117.39 5.34 -9.38 0.76 0
13027 220044 1 O2C13H20 A2B13C20 -92.91 1.51 -8.84 0.25 0
13028 220045 2 OC9H18 AB9C18 -171.81 4.47 -10.18 3.0 0
13029 220046 1 O3C11H14 A3B11C14 -127.0 5.28 -9.26 -0.06 0
13030 220066 1 OC16H34 AB16C34 -129.4 1.76 -10.18 2.9 0
13031 220082 2 ClNOH3C7 ABCD3E7 -2.66 1.45 -9.26 -1.25 0
13033 220131 3 O3C6H10 A3B6C10 -422.71 4.59 -10.16 0.16 0
13034 220174 1 SN2C10H10 AB2C10D10 50.87 1.59 -8.75 -0.35 0
13035 220200 1 O7C19H20 A7B19C20 -261.27 1.97 -10.05 -0.94 0
13036 220216 1 Cl6O7H12C18 A6B7C12D18 -270.09 2.95 -9.46 -1.4 0
13037 220224 1 PO3C4H11 AB3C4D11 -184.21 1.29 -10.96 0.89 0
13038 220225 3 NPCl2 ABC2 -167.32 0.02 -10.86 -1.18 0
13039 220247 1 SO4C6H12 AB4C6D12 -193.76 6.42 -10.48 0.27 0
13040 220271 1 NO2C8H17 AB2C8D17 -123.68 2.65 -9.77 1.04 0
13041 220295 1 O3H10C13 A3B10C13 -71.62 3.29 -9.31 -0.61 0
13042 220296 2 ClC5H6 AB5C6 -24.6 1.4 -9.25 -0.2 0
13043 220312 1 ClO3C10H11 AB3C10D11 -121.7 3.39 -9.37 -0.42 0
13044 220313 1 OI2H6C7 AB2C6D7 2.01 1.32 -9.12 -1.32 0
13045 220314 1 ClO2C10H11 AB2C10D11 -46.34 2.03 -8.44 -0.05 0
13046 220331 1 O2N3C10H11 A2B3C10D11 -30.37 4.39 -9.09 -1.06 0
13047 220347 1 O3C21H28 A3B21C28 -144.33 2.76 -9.34 -0.37 0
13048 220360 1 NO3C21H23 AB3C21D23 -91.17 7.34 -10.3 -1.21 0
13049 220368 1 ClN2O2H11C13 AB2C2D11E13 31.59 5.02 -10.32 -1.36 0
13050 220377 1 SO3C8H8 AB3C8D8 -85.41 5.08 -10.31 -0.87 0
13051 220379 1 Br2H8C9 A2B8C9 45.48 1.83 -9.61 -0.75 0
13052 220384 1 NO5C18H25 AB5C18D25 -149.63 8.55 -10.26 -1.22 0
13053 220389 1 N4O5H18C19 A4B5C18D19 6.11 3.92 -10.74 -1.6 0
13054 220391 1 N3O6H19C20 A3B6C19D20 -35.77 5.01 -10.66 -1.54 0
13055 220399 1 OH10C13 AB10C13 9.58 4.42 -8.85 -0.89 0
13056 220400 5 NC3H3 AB3C3 97.72 3.81 -9.12 -0.17 0
13057 220404 1 ON3C8H17 AB3C8D17 -50.12 4.41 -9.21 0.5 0
13058 220407 1 NO2H13C14 AB2C13D14 -29.81 4.74 -8.49 -0.38 0
13059 220439 1 NO2H11C12 AB2C11D12 -44.38 1.9 -9.02 -0.81 0
13060 220451 2 PO3C7H16 AB3C7D16 -426.99 4.01 -10.49 1.12 0
13061 220477 1 N3O3C14H15 A3B3C14D15 -89.84 5.49 -9.78 -0.48 0
13062 220479 1 N3O4C9H13 A3B4C9D13 -168.92 3.88 -9.8 -1.06 0
13063 220493 1 NOH13C17 ABC13D17 35.36 2.58 -9.37 -0.79 0
13064 220498 1 NOH15C18 ABC15D18 45.85 1.0 -8.49 -0.74 0
13065 220567 1 O3H16C25 A3B16C25 -7.74 1.2 -8.95 -1.4 0
13066 220588 2 N2C13H15 A2B13C15 102.91 5.25 -8.01 0.39 0
13067 220591 1 NSH7C8 ABC7D8 38.55 2.3 -8.32 -0.2 0
13068 220643 1 ClSO2C8H9 ABC2D8E9 -79.41 5.43 -9.96 -0.84 0
13069 220661 1 NOC12H21 ABC12D21 -76.71 4.29 -9.56 1.4 0
13070 220678 1 NO3C14H15 AB3C14D15 -78.32 6.18 -9.26 -1.14 0
13071 220693 1 ClNO3H10C12 ABC3D10E12 -104.92 2.86 -9.06 -1.29 0
13072 220697 1 OSN4H14C16 ABC4D14E16 58.0 4.34 -8.48 -0.83 0
13073 220726 2 OC9H9 AB9C9 -67.25 2.54 -8.82 -0.62 0