List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
216072 85085669 1 O3C13H18 A3B13C18 -131.95 2.62 -9.6 0.18 0
216073 85085670 1 OH14C16 AB14C16 35.59 3.24 -9.37 -0.28 0
216074 85085671 1 SO2C12H14 AB2C12D14 -29.08 6.89 -10.28 -0.64 0
216075 85085673 2 OC7H11 AB7C11 -103.07 3.81 -8.97 0.54 0
216076 85085675 2 OC7H11 AB7C11 -102.08 2.36 -9.3 0.4 0
216077 85085678 1 SiO2C11H24 AB2C11D24 -140.03 2.06 -8.85 0.67 0
216078 85085679 1 SiO2C12H17 AB2C12D17 -37.31 1.9 0.0 0.0 0
216079 85085680 1 SiO2C12H18 AB2C12D18 -79.4 1.23 -8.06 0.16 0
216080 85085682 2 C8H15 A8B15 -41.32 0.62 -9.0 1.01 0
216081 85085683 1 ClON4C9H11 ABC4D9E11 -20.47 4.57 -9.07 -0.3 0
216082 85085684 1 ClO4C9H15 AB4C9D15 -202.67 1.77 -10.47 0.53 0
216083 85085685 1 ON3C13H17 AB3C13D17 -6.68 5.04 -9.36 -0.27 0
216084 85085686 1 NO3C12H17 AB3C12D17 -125.88 2.69 -9.47 0.28 0
216085 85085687 1 NO3C12H17 AB3C12D17 -108.68 3.07 -8.9 -0.62 0
216086 85085689 1 IOC6H9 ABC6D9 -8.07 2.54 -9.52 -0.73 0
216087 85085690 1 BrNO2C7H14 ABC2D7E14 -105.91 1.59 -10.02 -0.26 0
216088 85085692 4 OC3H4 AB3C4 -134.36 3.12 -9.52 -0.4 0
216089 85085693 1 O3C13H20 A3B13C20 -146.15 2.0 -9.92 0.41 0
216090 85085695 1 S2O4C7H12 A2B4C7D12 -151.69 2.7 -8.55 -0.12 0
216091 85085696 1 OC16H16 AB16C16 4.05 4.85 -9.47 -0.59 0
216092 85085697 2 NOC6H10 ABC6D10 -76.39 0.02 -8.63 -0.12 0
216093 85085698 2 NOC6H10 ABC6D10 -46.55 2.58 -9.71 -0.7 0
216094 85085700 1 OS2C11H12 AB2C11D12 -5.58 4.74 -9.18 -0.42 0
216095 85085701 1 OC15H28 AB15C28 -76.67 1.93 -9.07 1.11 0
216096 85085704 1 NO2H11C14 AB2C11D14 -0.06 6.91 -8.86 -1.39 0
216097 85085710 1 O5C11H14 A5B11C14 -192.36 5.12 -10.06 -0.78 0
216098 85085711 2 NO2C5H7 AB2C5D7 -119.31 3.08 -10.43 -1.08 0
216099 85085713 1 ON4C12H12 AB4C12D12 26.89 5.82 -8.78 -0.32 0
216100 85085715 2 O2C6H9 A2B6C9 -161.75 6.16 -9.79 0.63 0
216101 85085716 2 O2C6H9 A2B6C9 -186.94 1.95 -9.73 0.65 0
216102 85085721 1 O3C13H22 A3B13C22 -164.93 4.02 -9.46 1.74 0
216103 85085728 1 ClN4C10H15 AB4C10D15 41.82 2.76 -8.62 0.02 0
216104 85085733 1 O5C11H16 A5B11C16 -224.54 2.47 -9.95 -0.26 0
216105 85085740 1 ON2C14H16 AB2C14D16 36.74 6.64 -8.4 -0.44 0
216106 85085741 1 O3C13H24 A3B13C24 -150.89 1.73 -9.78 1.33 0
216107 85085743 1 BrOC10H13 ABC10D13 -25.66 4.34 -9.99 -0.06 0
216108 85085744 1 NO5C10H15 AB5C10D15 -148.09 3.24 -10.93 -1.19 0
216109 85085745 1 NO5C10H15 AB5C10D15 -198.35 6.61 -10.0 0.06 0
216110 85085747 1 NO4C11H19 AB4C11D19 -181.53 3.27 -9.79 0.92 0
216111 85085748 1 NO4C11H19 AB4C11D19 -191.19 1.73 -9.95 0.33 0
216112 85085749 1 NO2C14H15 AB2C14D15 9.83 2.74 -9.66 0.1 0
216113 85085750 1 NO2C14H15 AB2C14D15 -51.53 2.57 -9.52 -1.09 0
216114 85085751 1 NOSH11C13 ABCD11E13 50.19 2.78 -8.6 -0.38 0
216115 85085752 1 SO2N3C9H15 AB2C3D9E15 -39.47 9.78 -8.51 -0.92 0
216116 85085753 1 NO2C13H27 AB2C13D27 -141.25 3.15 -9.59 0.88 0
216117 85085754 1 O2F4C9H14 A2B4C9D14 -296.49 4.19 -10.2 0.03 0
216118 85085755 1 N2O5C9H16 A2B5C9D16 -243.11 6.99 -10.15 0.2 0
216119 85085756 1 N2O3H10C12 A2B3C10D12 19.42 3.48 -8.96 -1.5 0
216120 85085757 1 N2O2C13H14 A2B2C13D14 -24.28 5.51 -9.2 -0.27 0
216121 85085758 1 ON4C12H18 AB4C12D18 58.19 2.22 -8.87 -0.51 0