List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
53077 14709526 1 O3N5C18H39 A3B5C18D39 -118.38 3.99 -8.79 1.77 0
53078 14709527 1 O4N5C20H43 A4B5C20D43 -164.19 6.51 -8.45 1.66 0
53079 14709529 2 OC6H9 AB6C9 -76.21 2.89 -9.83 -0.51 0
53080 14709530 2 OH9C10 AB9C10 -3.22 2.7 -9.36 -0.46 0
53081 14709531 1 OSC10H14 ABC10D14 -30.61 2.88 -9.34 -0.82 0
53082 14709533 1 OSH18C20 ABC18D20 32.34 2.73 -9.3 -0.9 0
53083 14709535 1 O2C9H12 A2B9C12 -45.23 1.27 -9.01 0.0 0
53084 14709537 1 OSC9H12 ABC9D12 -10.74 1.2 -9.04 -0.45 0
53085 14709539 2 OC6H9 AB6C9 -61.52 1.83 -8.79 0.06 0
53086 14709541 1 OSC12H18 ABC12D18 -25.32 1.67 -8.87 -0.39 0
53087 14709542 1 O2C9H12 A2B9C12 -48.62 1.01 -8.8 0.36 0
53088 14709544 1 O3C13H16 A3B13C16 -101.55 1.85 -8.89 -0.23 0
53089 14709545 1 O2H10C11 A2B10C11 -43.99 4.47 -9.37 -0.53 0
53090 14709546 1 O3H16C17 A3B16C17 -60.28 2.56 -8.9 -0.79 0
53091 14709547 2 OH6C8 AB6C8 -10.59 4.35 -9.4 -0.61 0
53092 14709548 1 O5C10H16 A5B10C16 -223.61 2.09 -10.74 -0.33 0
53093 14709549 1 O5C14H16 A5B14C16 -178.87 1.89 -9.8 -0.57 0
53094 14709550 1 O5C13H24 A5B13C24 -236.63 1.2 -10.04 0.13 0
53095 14709556 3 O2C5H8 A2B5C8 -285.96 3.09 -10.28 -0.23 0
53096 14709559 1 F3O3C11H13 A3B3C11D13 -270.65 2.71 -9.65 -0.21 0
53097 14709568 1 IC27H47 AB27C47 -84.89 2.96 -9.56 -0.58 0
53098 14709569 1 IC27H47 AB27C47 -77.04 2.4 -9.39 -0.56 0
53099 14709570 2 OSC4H7 ABC4D7 -82.51 3.37 -8.85 -1.04 0
53100 14709572 2 SO2C5H8 AB2C5D8 -161.34 3.76 -8.99 -1.19 0
53101 14709574 1 OS2C7H12 AB2C7D12 -22.52 2.97 -8.65 -0.86 0
53102 14709578 2 SC4H6 AB4C6 12.56 2.16 -8.41 -0.4 0
53103 14709579 1 NO3H19C24 AB3C19D24 -31.65 5.67 -8.64 -0.36 0
53104 14709581 1 NO2H21C24 AB2C21D24 -1.28 5.01 -8.39 -0.08 0
53105 14709584 1 NOC25H25 ABC25D25 45.23 1.39 -8.39 0.25 0
53106 14709585 1 NOC25H25 ABC25D25 44.33 2.49 -8.12 0.2 0
53107 14709586 1 NH25C26 AB25C26 107.58 1.59 -8.19 0.25 0
53108 14709593 1 NOH23C25 ABC23D25 65.82 2.29 -8.42 0.09 0
53109 14709594 1 NOH23C25 ABC23D25 63.35 3.23 -8.28 0.02 0
53110 14709598 1 AgNSO7C25H34 ABCD7E25F34 -334.02 18.61 -8.97 -3.86 0
53111 14709599 1 OSCl2N3H7C9 ABC2D3E7F9 24.07 4.46 -9.27 -1.0 0
53112 14709601 1 SCl2N3O3H11C16 AB2C3D3E11F16 -32.98 4.59 -9.17 -1.49 0
53113 14709602 1 SN3O3H15C17 AB3C3D15E17 -28.7 3.2 -8.97 -1.25 0
53114 14709603 1 SO2N3H15C18 AB2C3D15E18 15.36 2.83 -8.89 -1.16 0
53115 14709605 1 SO2N3H13C17 AB2C3D13E17 25.98 1.91 -9.04 -1.23 0
53116 14709606 2 ClOSN2H5C6 ABCD2E5F6 -7.24 5.93 -9.01 -1.53 0
53117 14709614 1 O2S2Cl3N4H11C18 A2B2C3D4E11F18 64.96 6.34 -8.92 -1.98 0
53118 14709616 1 NSCl2O2H5C9 ABC2D2E5F9 -20.18 2.91 -9.45 -1.51 0
53119 14709617 1 ClNO2C16H16 ABC2D16E16 -55.59 3.74 -9.5 -0.39 0
53120 14709618 1 NCl2O2H15C16 AB2C2D15E16 -66.4 2.42 -9.45 -0.55 0
53121 14709620 1 NOCl2H13C16 ABC2D13E16 -13.02 3.08 -9.4 -0.26 0
53122 14709623 1 ClN3H16C18 AB3C16D18 76.25 7.37 -9.6 -0.41 0
53123 14709624 1 NOC9H17 ABC9D17 -20.04 1.61 -9.16 1.24 0
53124 14709625 1 NO2C12H21 AB2C12D21 -74.85 2.87 -9.55 1.0 0
53125 14709626 1 NO2C16H21 AB2C16D21 -32.01 5.95 -9.24 -0.24 0
53126 14709627 1 NO2C12H23 AB2C12D23 -99.17 3.38 -9.27 1.28 0