List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
351085 127279522 2 ON2C9H18 AB2C9D18 -124.01 3.24 -8.69 1.53 0
351086 127279523 2 ON2C10H16 AB2C10D16 -77.0 2.76 -8.88 0.47 0
351087 127279524 1 N3O3C19H27 A3B3C19D27 -106.05 2.69 -8.65 0.05 0
351088 127279525 1 ON5C15H25 AB5C15D25 -37.66 4.87 -9.33 0.41 0
351089 127279526 1 N3O4C21H31 A3B4C21D31 -148.4 3.62 -8.58 0.06 0
351090 127279527 1 N3O3C20H31 A3B3C20D31 -131.39 5.54 -8.75 0.12 0
351091 127279528 1 N3O3C23H27 A3B3C23D27 -98.18 4.01 -8.85 -0.21 0
351092 127279529 1 O2N3C19H27 A2B3C19D27 -66.34 2.32 -8.77 0.09 0
351093 127279530 1 O2N4C17H32 A2B4C17D32 -91.36 1.89 -8.85 1.32 0
351094 127279531 1 ON3C15H27 AB3C15D27 -54.62 5.55 -8.37 1.32 0
351095 127279532 1 SN3O3C19H29 AB3C3D19E29 -138.32 3.12 -8.89 -0.62 0
351096 127279654 1 SO2N5C17H29 AB2C5D17E29 -57.07 3.84 -8.8 -0.46 0
351097 127279655 1 SO2N5C19H33 AB2C5D19E33 -71.28 2.8 -8.85 -0.27 0
351098 127279656 1 N3O3C20H31 A3B3C20D31 -122.42 2.01 -8.87 0.11 0
351099 127279657 1 S2O3N4C11H16 A2B3C4D11E16 -56.47 7.55 -8.85 -0.84 0
351100 127279658 1 ClO2N3C21H24 AB2C3D21E24 -54.19 3.52 -9.41 -0.39 0
351101 127279659 1 NSO2C14H19 ABC2D14E19 -74.34 3.24 -9.14 -0.52 0
351102 127279660 1 O2N3S3C12H13 A2B3C3D12E13 -12.37 5.41 -8.39 -1.54 0
351103 127279661 1 NSO2C14H19 ABC2D14E19 -78.84 5.32 -9.22 -0.47 0
351104 127279662 1 SO2N4C21H22 AB2C4D21E22 -0.54 10.32 -8.79 -1.17 0
351105 127279663 1 OS2N5C18H19 AB2C5D18E19 40.16 2.43 -8.75 -1.0 0
351106 127279664 1 N2O2S2H14C15 A2B2C2D14E15 -14.39 6.76 -9.02 -1.19 0
351107 127279665 1 SN2O3C20H26 AB2C3D20E26 -108.6 8.8 -8.63 -0.54 0
351108 127279666 1 SO2N3C20H21 AB2C3D20E21 -27.53 2.18 -8.27 -0.89 0
351109 127279667 1 SN2O3C18H18 AB2C3D18E18 -81.15 7.48 -8.2 -0.97 0
351110 127279668 1 NSO4C20H23 ABC4D20E23 -128.28 5.3 -8.71 -0.77 0
351111 127279669 1 NSO4C22H25 ABC4D22E25 -126.84 5.41 -8.74 -0.66 0
351112 127279670 1 NSO4C20H21 ABC4D20E21 -125.91 3.17 -8.27 -1.04 0
351113 127279671 1 SO2N3H19C20 AB2C3D19E20 15.82 5.08 -8.73 -1.03 0
351114 127279672 1 NSO3C13H17 ABC3D13E17 -109.33 2.08 -9.28 -0.74 0
351115 127279673 1 SO2N4C20H20 AB2C4D20E20 7.38 3.75 -8.32 -1.03 0
351116 127279674 1 SN2O3C14H18 AB2C3D14E18 -108.73 2.56 -9.29 -0.72 0
351117 127279675 1 NSO3C14H19 ABC3D14E19 -115.94 2.14 -9.24 -0.7 0
351118 127279676 1 SN2O3C19H20 AB2C3D19E20 -80.58 6.3 -9.07 -1.0 0
351119 127279677 1 S2N3O4C17H19 A2B3C4D17E19 -99.48 4.9 -9.27 -1.14 0
351120 127279678 1 SN3O3C18H23 AB3C3D18E23 -59.33 2.74 -9.33 -0.77 0
351121 127279679 1 O2N5C18H21 A2B5C18D21 17.82 5.33 -9.18 -0.85 0
351122 127279680 1 SO2N3C14H17 AB2C3D14E17 -25.81 0.56 -9.3 -0.93 0
351123 127279681 1 SO2N3C17H23 AB2C3D17E23 -41.76 7.32 -8.83 -0.98 0
351124 127279682 1 SN2O3C22H26 AB2C3D22E26 -101.79 4.17 -8.99 -0.83 0
351125 127279683 1 SN2O3C17H22 AB2C3D17E22 -97.7 3.45 -9.27 -0.67 0
351126 127279684 1 OS2N4C20H20 AB2C4D20E20 35.31 3.43 -8.5 -0.97 0
351127 127279685 1 SN2O3C17H24 AB2C3D17E24 -129.42 2.91 -9.28 -0.59 0
351128 127279686 1 N2S2O3C18H24 A2B2C3D18E24 -107.67 8.09 -8.76 -0.64 0
351129 127279687 1 NSO3C19H23 ABC3D19E23 -104.61 4.87 -8.76 -0.7 0
351130 127279688 1 N3O5C20H23 A3B5C20D23 -201.19 6.42 -8.44 -0.42 0
351131 127279689 1 N2O4C19H22 A2B4C19D22 -155.74 1.09 -8.65 -0.53 0
351132 127279690 1 SN3O3C19H25 AB3C3D19E25 -94.62 2.78 -9.39 -1.28 0
351133 127279691 1 N2O2S2C17H20 A2B2C2D17E20 -45.13 3.45 -8.7 -0.98 0
351134 127279692 1 SN3O4C18H23 AB3C4D18E23 -161.67 5.59 -8.5 -0.4 0
351135 127279693 1 N2O2S2C19H20 A2B2C2D19E20 -29.28 3.45 -8.64 -1.42 0
351136 127279694 1 O3N4C19H20 A3B4C19D20 -71.11 7.98 -8.37 -0.74 0
351137 127279695 1 NSO5C19H27 ABC5D19E27 -206.46 7.33 -8.49 0.02 0
351138 127279696 1 SN3O4C19H31 AB3C4D19E31 -153.03 2.28 -9.56 -0.3 0
351139 127279697 1 OSN5C19H27 ABC5D19E27 21.84 6.68 -8.73 -0.79 0
351140 127279698 1 NSO3C14H19 ABC3D14E19 -112.4 3.2 -9.3 -0.63 0
351141 127279699 1 ClNOC14H16 ABCD14E16 -32.27 4.3 -9.39 -0.34 0
351142 127279700 1 NSO3C17H29 ABC3D17E29 -160.88 5.04 -9.56 0.71 0
351143 127279701 1 SO2N3C19H27 AB2C3D19E27 -58.41 5.52 -8.64 -0.96 0
351144 127279702 1 ClNO2C15H18 ABC2D15E18 -78.93 4.03 -9.29 -0.4 0
351145 127279703 1 FSO2N4H19C20 ABC2D4E19F20 -48.53 3.86 -8.98 -1.01 0
351146 127279704 1 N2O2S2C17H20 A2B2C2D17E20 -41.36 4.14 -8.78 -1.1 0
351147 127279705 1 SN2O2C20H22 AB2C2D20E22 -52.56 3.59 -7.89 -0.88 0
351148 127279706 1 SO2N3C21H21 AB2C3D21E21 0.0 6.1 -8.8 -0.79 0
351149 127279707 1 SN2O3C22H26 AB2C3D22E26 -102.6 5.37 -8.93 -1.0 0
351150 127279708 2 NOSC9H9 ABCD9E9 -29.01 4.03 -8.72 -1.15 0
351151 127279709 1 NSO4C21H23 ABC4D21E23 -121.86 5.27 -8.79 -0.75 0
351152 127279710 1 OSN2C14H18 ABC2D14E18 -18.76 4.29 -9.14 -0.81 0
351153 127279711 1 SN2O3C21H22 AB2C3D21E22 -63.6 3.78 -8.99 -1.05 0
351154 127279712 1 SN2O4C15H20 AB2C4D15E20 -145.52 7.0 -9.1 -0.97 0
351155 127279713 1 O3N4C20H30 A3B4C20D30 -103.14 0.7 -8.4 0.08 0
351156 127279714 1 NSO2C15H21 ABC2D15E21 -80.62 3.31 -9.13 -0.53 0
351157 127279715 1 SN3O3C20H29 AB3C3D20E29 -111.12 3.12 -8.62 -0.37 0
351158 127279716 1 SO2N4C12H14 AB2C4D12E14 1.29 7.26 -9.34 -1.4 0
351159 127279717 1 SN3O4C19H25 AB3C4D19E25 -147.0 9.45 -8.68 -0.67 0
351160 127279718 1 NSO3C13H17 ABC3D13E17 -103.59 3.75 -9.2 -0.7 0
351161 127279719 2 NOSH8C9 ABCD8E9 2.79 3.64 -8.72 -1.13 0
351162 127279720 1 SN2O4C19H26 AB2C4D19E26 -172.11 2.67 -9.04 -0.58 0
351163 127279721 1 SN3O3C17H27 AB3C3D17E27 -113.9 3.32 -8.91 0.05 0
351164 127279722 1 SO2N3C19H25 AB2C3D19E25 -60.55 6.14 -8.68 -1.08 0
351165 127279723 1 ON5C19H23 AB5C19D23 17.78 3.55 -8.91 -1.14 0
351166 127279724 1 SN2O3C17H24 AB2C3D17E24 -130.95 2.05 -9.06 -0.66 0
351167 127279725 1 N3O3C23H31 A3B3C23D31 -131.72 7.28 -8.57 0.16 0
351168 127279726 1 SN2O3C17H24 AB2C3D17E24 -129.91 1.88 -9.42 -0.84 0
351169 127279727 1 SO3N4C19H30 AB3C4D19E30 -106.86 4.53 -8.75 -0.32 0
351170 127279728 1 SN3O3C19H27 AB3C3D19E27 -114.35 4.32 -8.78 -0.6 0
351171 127279729 1 NSO4C20H29 ABC4D20E29 -186.32 4.92 -8.5 -0.15 0
351172 127279730 1 SO3N4C18H22 AB3C4D18E22 -71.94 5.39 -8.82 -1.0 0
351173 127279731 1 ClNO2C14H18 ABC2D14E18 -87.36 3.13 -9.38 -0.4 0
351174 127279732 1 NSO3C14H19 ABC3D14E19 -112.8 4.33 -9.27 -0.68 0
351175 127279733 1 OSN5C19H27 ABC5D19E27 16.05 4.66 -8.78 -0.57 0
351176 127279734 1 O2N3S3C17H19 A2B3C3D17E19 -14.34 5.81 -8.94 -0.97 0
351177 127279735 1 S2N3O3C15H23 A2B3C3D15E23 -131.03 3.95 -8.64 -0.12 0
351178 127279736 2 NSO2C9H11 ABC2D9E11 -123.86 3.81 -8.89 -0.43 0
351179 127279737 1 O2S2N3C19H21 A2B2C3D19E21 -31.3 4.88 -8.89 -1.15 0
351180 127279738 1 N2S2O3C19H20 A2B2C3D19E20 -75.61 6.17 -8.59 -1.17 0
351181 127279739 1 N2S2O3C19H20 A2B2C3D19E20 -79.3 5.57 -9.04 -0.85 0
351182 127279740 1 S2N3O3C18H19 A2B3C3D18E19 -80.96 7.34 -9.0 -1.34 0
351183 127279741 1 SO2N5C17H25 AB2C5D17E25 -41.55 7.98 -8.59 -0.69 0
351184 127279742 1 SN3O4C18H27 AB3C4D18E27 -183.18 8.14 -8.9 -0.07 0