List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
295750 117543604 1 NOH9C12 ABC9D12 60.3 4.21 -8.56 -0.66 0
295751 117543605 1 O2C13H14 A2B13C14 -12.88 6.16 -8.71 -0.61 0
295752 117543635 1 NO3C15H17 AB3C15D17 -95.02 3.55 -8.75 -0.12 0
295753 117543699 1 ClOC9H17 ABC9D17 -98.68 2.59 -10.4 0.78 0
295754 117543700 1 ClOC8H15 ABC8D15 -90.72 1.57 -10.39 0.74 0
295755 117543701 1 ClO3C11H15 AB3C11D15 -133.05 3.07 -9.0 -0.06 0
295756 117543703 1 NOC8H9 ABC8D9 15.04 2.98 -10.2 -0.26 0
295757 117543704 1 ClOC9H9 ABC9D9 -5.27 1.93 -9.61 -0.27 0
295758 117543705 1 OC12H16 AB12C16 -14.23 2.72 -9.22 0.27 0
295759 117543712 1 O3C12H16 A3B12C16 -82.18 2.78 -8.18 0.09 0
295760 117543713 1 O3C12H14 A3B12C14 -72.37 3.53 -8.75 0.01 0
295761 117543716 1 FO2C10H11 AB2C10D11 -79.76 1.35 -8.95 -0.16 0
295762 117543734 1 ON2C12H18 AB2C12D18 -30.57 3.44 -9.09 -0.09 0
295763 117543760 1 FNOC13H18 ABCD13E18 -88.8 1.36 -9.03 -0.02 0
295764 117543761 1 ON2C15H20 AB2C15D20 -22.97 1.8 -8.4 0.06 0
295765 117543762 1 NO2C16H25 AB2C16D25 -96.38 1.56 -8.54 0.38 0
295766 117543763 1 FNO2C14H20 ABC2D14E20 -124.73 0.7 -8.78 -0.01 0
295767 117543772 1 NO2C16H25 AB2C16D25 -92.67 3.57 -8.51 0.4 0
295768 117543819 1 NO2C15H21 AB2C15D21 -74.06 4.37 -8.59 0.26 0
295769 117543840 2 NC7H11 AB7C11 -0.07 2.21 -8.63 0.48 0
295770 117543858 2 NOC7H10 ABC7D10 -56.16 2.23 -8.62 0.02 0
295771 117543888 1 ON2C12H18 AB2C12D18 -32.82 2.6 -8.89 -0.03 0
295772 117543895 1 FNOC13H18 ABCD13E18 -88.62 2.49 -8.87 0.04 0
295773 117543904 1 NOC16H25 ABC16D25 -60.61 2.57 -8.78 0.46 0
295774 117543906 1 NO2C15H23 AB2C15D23 -89.7 3.89 -8.7 0.34 0
295775 117543919 1 NO2C16H25 AB2C16D25 -97.99 2.03 -8.52 0.4 0
295776 117543926 1 NOC15H23 ABC15D23 -59.32 2.65 -8.72 0.45 0
295777 117543963 1 NO3C14H17 AB3C14D17 -91.82 3.54 -8.72 -0.08 0
295778 117543965 1 NO3C15H21 AB3C15D21 -110.06 4.92 -8.58 0.32 0
295779 117543972 1 FNO2C14H18 ABC2D14E18 -111.96 3.62 -8.83 -0.06 0
295780 117543975 1 FNO2C14H18 ABC2D14E18 -111.32 2.82 -8.89 -0.26 0
295781 117544004 1 ON2C14H22 AB2C14D22 -32.91 2.84 -8.57 0.34 0
295782 117544006 1 ClN2C13H19 AB2C13D19 -3.31 1.64 -8.82 0.0 0
295783 117544009 1 N3C15H25 A3B15C25 8.11 1.8 -8.04 0.55 0
295784 117544021 1 FN2C13H19 AB2C13D19 -41.36 1.5 -8.8 0.02 0
295785 117544028 1 ON2C15H24 AB2C15D24 -41.67 1.52 -8.39 0.49 0
295786 117544035 2 NC4H9 AB4C9 -24.24 2.43 -8.52 2.76 0
295787 117544038 2 NC5H11 AB5C11 -33.84 2.22 -8.52 2.78 0
295788 117544039 1 N2C11H24 A2B11C24 -39.66 2.25 -8.51 2.79 0
295789 117544040 1 N2C13H26 A2B13C26 -40.36 1.97 -8.47 2.72 0
295790 117544056 1 NO2C15H23 AB2C15D23 -85.0 1.69 -8.69 0.34 0
295791 117544057 1 NO2C15H23 AB2C15D23 -84.14 2.18 -8.62 0.32 0
295792 117544069 1 FNOC14H20 ABCD14E20 -92.52 2.12 -8.82 0.02 0
295793 117544070 1 ON2C16H22 AB2C16D22 -26.51 2.6 -8.38 0.06 0
295794 117544089 1 ON2C13H18 AB2C13D18 -18.59 2.12 -8.97 -0.16 0
295795 117544122 1 NOC11H21 ABC11D21 -68.85 2.74 -8.59 0.64 0
295796 117544197 1 NOC16H25 ABC16D25 -64.05 1.54 -8.74 0.64 0
295797 117544202 1 NOC11H23 ABC11D23 -88.54 2.02 -8.63 2.65 0
295798 117544258 1 NO2C15H23 AB2C15D23 -82.85 3.23 -8.77 0.27 0
295799 117544294 1 NOC15H21 ABC15D21 -39.53 3.4 -8.78 0.46 0