List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
285700 104120139 1 BrFN2O2H12C13 ABC2D2E12F13 -28.53 3.56 -9.41 -0.81 0
285701 104120286 1 F2N2O2C7H10 A2B2C2D7E10 -137.88 3.26 -9.25 -0.3 0
285702 104120353 1 N2O3C14H26 A2B3C14D26 -128.36 0.99 -9.03 0.2 0
285703 104120360 1 N2O3C11H18 A2B3C11D18 -109.65 1.46 -9.37 0.1 0
285704 104120624 1 BrN3C10H16 AB3C10D16 23.12 3.78 -8.64 -0.23 0
285705 104120625 1 N3C10H17 A3B10C17 18.57 3.58 -8.68 0.17 0
285706 104120661 1 BrN3C11H18 AB3C11D18 18.31 3.76 -8.94 -0.36 0
285707 104120665 2 N2C5H9 A2B5C9 26.85 3.92 -8.75 -0.17 0
285708 104120842 1 N4C11H20 A4B11C20 16.31 2.8 -8.65 -0.26 0
285709 104121028 1 N3C17H25 A3B17C25 7.91 5.76 -8.45 -0.32 0
285710 104121064 1 N3C14H25 A3B14C25 -16.26 3.64 -8.68 0.19 0
285711 104121165 1 N3C10H15 A3B10C15 38.89 5.21 -8.88 0.18 0
285712 104121364 1 ClN3C11H18 AB3C11D18 -4.49 4.62 -8.48 -0.04 0
285713 104121457 3 NC4H7 AB4C7 2.98 1.51 -8.29 0.4 0
285714 104121459 2 N2C6H11 A2B6C11 6.84 0.78 -8.6 0.18 0
285715 104121466 1 N3C17H25 A3B17C25 15.14 3.57 -8.33 -0.24 0
285716 104121538 1 N4C11H20 A4B11C20 11.8 1.42 -8.66 0.08 0
285717 104121691 1 O2N3C12H13 A2B3C12D13 -29.73 3.49 -9.52 -1.27 0
285718 104121736 1 NO3C15H15 AB3C15D15 -87.07 5.37 -9.16 -0.93 0
285719 104121757 1 NO4C15H15 AB4C15D15 -113.81 3.86 -9.03 -0.94 0
285720 104121859 1 ClN2O5H9C13 AB2C5D9E13 -75.62 5.59 -10.14 -1.81 0
285721 104121860 1 NO4C15H15 AB4C15D15 -114.94 6.79 -9.13 -0.94 0
285722 104121861 1 FN2O5H9C13 AB2C5D9E13 -111.96 5.7 -10.14 -1.88 0
285723 104121866 1 NF2O3H9C13 AB2C3D9E13 -153.99 5.79 -9.94 -1.06 0
285724 104122086 1 ClO2N3H14C15 AB2C3D14E15 -49.46 4.57 -8.9 -1.06 0