List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
21999 594706 2 NO2C7H7 AB2C7D7 -51.58 2.06 -8.98 -0.42 0
22000 594707 4 OC5H6 AB5C6 -164.6 1.72 -8.9 -0.62 0
22001 594709 1 NO3H7C9 AB3C7D9 -77.28 4.76 -10.04 -1.35 0
22002 594712 1 O4C15H26 A4B15C26 -206.71 3.15 -9.99 0.45 0
22003 594740 1 S2C7H12 A2B7C12 19.77 1.38 -8.17 0.18 0
22004 594781 4 C3H4 A3B4 22.04 1.0 -10.18 1.84 0
22005 594839 1 NC12H17 AB12C17 5.32 2.0 -8.03 0.6 0
22006 594893 1 NC12H17 AB12C17 7.93 1.64 -8.62 0.41 0
22007 594895 1 NOC11H13 ABC11D13 -9.48 4.25 -8.71 0.16 0
22008 594896 1 NOC11H13 ABC11D13 -9.54 1.44 -9.04 -0.2 0
22009 594898 1 NO2C12H13 AB2C12D13 -55.69 6.07 -9.23 -1.34 0
22010 594983 2 OC10H12 AB10C12 -72.33 4.7 -8.52 0.39 0
22011 594984 1 ClNO2H14C17 ABC2D14E17 -37.34 4.92 -8.92 -0.56 0
22012 594985 1 NO2C19H25 AB2C19D25 -54.63 3.25 -8.49 0.39 0
22013 595003 1 O2N3C20H23 A2B3C20D23 -46.56 3.92 -8.7 -1.08 0
22014 595015 1 NO2C18H23 AB2C18D23 -74.28 2.66 -8.59 0.33 0
22015 595057 1 NO2C14H17 AB2C14D17 -50.32 4.6 -8.99 -0.34 0
22016 595060 1 ON6C26H28 AB6C26D28 118.36 5.21 -8.42 -1.28 0
22017 595090 1 NO3C18H19 AB3C18D19 -99.78 9.98 -9.42 -0.82 0
22018 595169 1 C13H20 A13B20 -4.9 1.53 -8.76 1.39 0
22019 595252 1 N3C9H11 A3B9C11 28.91 1.69 -8.05 0.14 0
22020 595275 1 O2C17H26 A2B17C26 -126.2 2.45 -8.72 0.96 0
22021 595348 1 O2C19H28 A2B19C28 -82.6 3.83 -8.86 -0.57 0
22022 595365 1 NSO2C12H13 ABC2D12E13 -45.51 5.7 -8.74 -1.15 0
22023 595370 3 C5H8 A5B8 -12.54 1.03 -9.41 1.57 0