List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
338772 127259783 2 NOC12H17 ABC12D17 -73.34 2.27 -8.54 0.09 0
338773 127259784 1 NO2C14H21 AB2C14D21 -83.33 2.23 -8.68 0.16 0
338774 127259785 1 NO3C23H27 AB3C23D27 -109.9 2.94 -9.48 0.11 0
338775 127259786 1 O2C15H18 A2B15C18 -64.11 1.89 -9.54 0.16 0
338776 127259787 1 NO2C18H27 AB2C18D27 -77.1 1.95 -8.6 0.13 0
338777 127259788 1 BrO2C11H13 AB2C11D13 -78.3 2.78 -9.68 -0.48 0
338778 127259789 1 NO3C18H25 AB3C18D25 -127.27 1.59 -9.12 0.06 0
338779 127259790 1 NO3C20H29 AB3C20D29 -149.43 2.61 -9.08 0.06 0
338780 127259791 1 ClNO2C19H30 ABC2D19E30 -137.02 3.5 -8.85 0.15 0
338781 127259792 1 NO2C19H29 AB2C19D29 -95.89 1.17 -8.74 0.21 0
338782 127259793 1 NO4H23C24 AB4C23D24 -95.1 6.22 -9.37 -1.52 0
338783 127259794 1 NO3H23C26 AB3C23D26 -5.38 2.2 -9.04 -0.25 0
338784 127259795 1 O3C12H16 A3B12C16 -127.35 1.01 -9.58 0.1 0
338785 127259796 1 O3C15H22 A3B15C22 -150.55 3.25 -9.66 0.05 0
338786 127259797 1 O3C16H24 A3B16C24 -155.51 3.33 -9.67 0.03 0
338787 127259798 1 NO4C14H17 AB4C14D17 -151.28 1.52 -9.59 -0.21 0
338788 127259799 1 NO3C20H27 AB3C20D27 -105.28 3.32 -9.12 0.11 0
338789 127259800 1 NO3C16H19 AB3C16D19 -78.05 2.15 -9.01 0.1 0
338790 127259801 1 NO3C25H35 AB3C25D35 -126.85 2.69 -8.61 0.02 0
338791 127259802 3 OH6C7 AB6C7 -62.82 2.49 -9.6 -0.18 0
338792 127259803 1 ClNSO3C20H24 ABCD3E20F24 -129.28 4.69 -8.53 -0.24 0
338793 127259804 1 NSO3C20H23 ABC3D20E23 -90.19 3.39 -8.44 -0.11 0
338794 127259805 1 SO3H14C15 AB3C14D15 -79.99 4.79 -9.66 -1.07 0
338795 127259806 1 ClNO2C21H28 ABC2D21E28 -94.08 2.03 -8.48 0.08 0
338796 127259807 1 NO2C21H27 AB2C21D27 -61.47 1.57 -8.62 0.12 0
338797 127259808 2 OC11H13 AB11C13 -75.31 2.04 -9.44 0.2 0
338798 127259809 1 NO3C21H25 AB3C21D25 -85.21 1.66 -8.73 0.08 0
338799 127259810 1 ClO3C18H19 AB3C18D19 -94.87 2.54 -9.46 -0.03 0
338800 127259811 1 ClO3H21C23 AB3C21D23 -80.55 2.72 -9.0 -0.08 0
338801 127259812 1 N2O3C22H28 A2B3C22D28 -117.1 2.23 -9.31 0.33 0
338802 127259813 1 ClNO3C20H30 ABC3D20E30 -182.12 1.58 -8.98 0.13 0
338803 127259814 1 NO3C20H29 AB3C20D29 -148.36 1.13 -9.02 0.09 0
338804 127259815 1 NCl2O2C22H29 AB2C2D22E29 -109.37 4.73 -9.65 -0.1 0
338805 127259816 1 ClNO2C22H28 ABC2D22E28 -70.9 2.71 -9.15 0.11 0
338806 127259817 1 NSO2H17C19 ABC2D17E19 -13.61 2.23 -9.08 -0.82 0
338807 127259818 1 O2H22C23 A2B22C23 -27.41 1.58 -9.26 0.13 0
338808 127259819 1 NO4H17C18 AB4C17D18 -125.22 6.46 -9.81 -0.54 0
338809 127259820 1 ClSO4C15H19 ABC4D15E19 -179.77 2.89 -9.35 -0.36 0
338810 127259821 1 ClNSO2C15H16 ABCD2E15F16 -54.15 1.99 -8.98 -0.13 0
338811 127259822 1 NO4H13C17 AB4C13D17 -115.12 4.88 -10.14 -1.14 0
338812 127259823 1 NO5C14H17 AB5C14D17 -185.39 3.15 -9.73 -0.26 0
338813 127259824 1 O3C16H22 A3B16C22 -139.49 2.87 -9.63 0.1 0
338814 127259825 1 NO2C23H23 AB2C23D23 -17.72 2.41 -9.03 -0.09 0
338815 127259826 1 N2O2C23H32 A2B2C23D32 -68.21 4.07 -8.33 0.17 0
338816 127259827 1 NH17C18 AB17C18 119.03 5.01 -9.26 -0.46 0
338817 127259828 1 NO4C18H19 AB4C18D19 -67.06 4.78 -9.54 -1.46 0
338818 127259829 1 NO4H19C21 AB4C19D21 -41.7 3.9 -9.5 -1.65 0
338819 127259830 1 NO2C22H29 AB2C22D29 -66.85 2.79 -8.78 0.36 0
338820 127259831 1 NCl2O2C21H25 AB2C2D21E25 -80.76 2.55 -8.5 0.02 0
338821 127259832 1 O3C13H18 A3B13C18 -135.96 1.8 -9.47 0.3 0