List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
141613 52902655 1 N2O3C14H14 A2B3C14D14 -71.31 5.92 -9.72 -1.14 0
141614 52902697 1 O3N5C17H21 A3B5C17D21 -42.09 8.83 -9.8 -1.15 1
141615 52903077 1 O3N5C23H32 A3B5C23D32 -37.24 3.41 0.0 0.0 0
141616 52903078 1 ClFO2N3H19C21 ABC2D3E19F21 -8.28 6.31 -8.88 -1.35 1
141617 52903438 1 ClOSN4H22C26 ABCD4E22F26 100.85 9.88 0.0 0.0 1
141618 52903439 1 SO4N5H22C26 AB4C5D22E26 64.92 6.18 0.0 0.0 -1
141619 52903440 1 SN4O4H21C28 AB4C4D21E28 78.79 5.63 0.0 0.0 0
141620 52903441 1 SN4O4H22C28 AB4C4D22E28 43.72 3.91 -8.8 -2.12 0
141621 52903442 1 ClFON5H15C23 ABCD5E15F23 76.59 4.45 -9.43 -1.61 0
141622 52903443 1 SO3N4H26C28 AB3C4D26E28 31.72 4.7 -8.39 -1.08 0
141623 52903444 1 SO3N4H26C28 AB3C4D26E28 37.5 6.69 -8.34 -1.08 0
141624 52903565 1 N3O3C13H13 A3B3C13D13 -59.69 4.33 -9.33 -1.09 -1
141625 52903566 1 N3O3H12C13 A3B3C12D13 -3.3 2.79 0.0 0.0 -1
141626 52903859 1 ClN2O3H8C12 AB2C3D8E12 -58.6 2.27 0.0 0.0 0
141627 52903860 1 ClN2O3H9C12 AB2C3D9E12 -82.15 4.13 -9.9 -1.65 -1
141628 52903861 1 SN2O3H7C10 AB2C3D7E10 -44.6 3.21 0.0 0.0 0
141629 52904533 1 N2O4C21H22 A2B4C21D22 -69.68 5.0 -8.3 -0.78 0
141630 52904534 1 ClN2O4H19C20 AB2C4D19E20 -71.02 6.35 -8.64 -0.78 0
141631 52904885 1 BrNO3C10H12 ABC3D10E12 -123.7 2.62 -8.74 -1.1 1
141632 52905036 1 ON2C17H17 AB2C17D17 26.51 2.41 0.0 0.0 0
141633 52905037 1 ON2H16C17 AB2C16D17 12.36 4.19 -8.99 -0.2 0
141634 52905494 1 NO7C26H31 AB7C26D31 -248.44 9.32 -8.54 -0.66 0
141635 52905863 1 SO3N4C14H18 AB3C4D14E18 -80.51 4.35 -8.72 -1.1 0
141636 52906074 1 FOSN3C17H20 ABCD3E17F20 -47.62 2.59 -8.64 -0.82 0
141637 52906075 1 FOSN3H18C21 ABCD3E18F21 9.46 1.13 -8.62 -0.97 0
141638 52906076 1 ClFOSN4H18C20 ABCDE4F18G20 -4.13 3.12 -8.58 -1.15 0
141639 52906077 1 FSO2N4C21H21 ABC2D4E21F21 -28.61 1.91 -8.23 -0.98 1
141640 52906608 1 OSN3C18H24 ABC3D18E24 4.95 4.22 0.0 0.0 0
141641 52906871 1 ON4C18H20 AB4C18D20 51.74 5.52 -8.78 -0.58 0
141642 52906872 1 N2O3C18H20 A2B3C18D20 -58.94 1.98 -8.76 -0.99 0
141643 52906873 1 N2O3C18H20 A2B3C18D20 -40.8 5.74 -8.8 -0.04 0
141644 52907590 1 ON7C25H31 AB7C25D31 70.73 8.6 -8.27 -0.57 0
141645 52907669 1 SO2N7C22H23 AB2C7D22E23 56.3 4.66 -8.54 -0.74 0
141646 52908056 1 FSO2N4H11C14 ABC2D4E11F14 5.24 3.71 -8.92 -0.7 0
141647 52908157 1 SN2F3O4C10H11 AB2C3D4E10F11 -302.85 2.47 -9.5 -0.98 0
141648 52908319 1 BrFNOC12H15 ABCDE12F15 -77.6 2.44 -10.26 -0.97 0
141649 52908543 1 SN3O5C25H27 AB3C5D25E27 -157.42 5.24 -8.58 -0.89 0
141650 52908700 1 S2O3N4C17H18 A2B3C4D17E18 12.4 5.28 -9.29 -0.77 0
141651 52908712 1 SN2O3C24H30 AB2C3D24E30 -94.44 3.66 -8.45 -0.37 -1
141652 52908826 1 S2N3O3C22H24 A2B3C3D22E24 -7.33 3.43 0.0 0.0 0
141653 52908907 1 O2N3C21H27 A2B3C21D27 -41.23 8.47 -8.34 -0.2 0
141654 52908908 1 SN2O3C20H24 AB2C3D20E24 -110.95 1.95 -8.98 -0.6 1
141655 52909394 1 SO2N4C28H33 AB2C4D28E33 -10.52 4.35 0.0 0.0 0
141656 52909557 1 ClS2N3O5C21H24 AB2C3D5E21F24 -73.87 13.24 -9.01 -0.97 -1
141657 52909610 1 SO2N4C15H15 AB2C4D15E15 55.1 12.28 0.0 0.0 0
141658 52909704 3 NOH9C10 ABC9D10 -22.06 8.88 -9.36 -0.99 -1
141659 52909705 1 N3O3H26C30 A3B3C26D30 25.49 5.55 0.0 0.0 0
141660 52910018 1 SN4O4C26H30 AB4C4D26E30 -81.99 5.23 -8.32 -0.45 1
141661 52910236 1 ON4C15H25 AB4C15D25 -17.06 6.64 0.0 0.0 0
141662 52910584 1 N4O5C27H36 A4B5C27D36 -194.08 5.06 -8.07 -0.37 0