List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
22657 598230 2 NC7H8 AB7C8 34.48 1.4 -9.4 -0.68 0
22658 598231 1 NO2H13C14 AB2C13D14 -9.77 2.73 -9.0 -0.2 0
22659 598233 1 OSN2C17H18 ABC2D17E18 33.49 6.79 -8.7 -0.83 0
22660 598242 1 ON2H10C12 AB2C10D12 23.34 4.18 -8.48 -0.43 0
22661 598270 1 NO3H9C13 AB3C9D13 -77.23 6.65 -9.3 -1.54 0
22662 598271 1 ClNOC14H14 ABCD14E14 0.91 1.14 -9.59 -0.36 0
22663 598272 1 O2N3C25H27 A2B3C25D27 -10.73 4.12 -8.7 -0.4 0
22664 598309 3 O5C9H12 A5B9C12 -673.05 3.97 -9.45 0.4 0
22665 598312 1 N2O2C21H24 A2B2C21D24 -2.38 3.52 -8.12 0.11 0
22666 598313 1 SO2C20H34 AB2C20D34 -131.97 3.28 -9.09 -0.77 0
22667 598315 2 SO2C8H9 AB2C8D9 -119.21 3.08 -7.98 -0.58 0
22668 598320 1 SO2C26H46 AB2C26D46 -160.48 3.34 -9.08 -0.75 0
22669 598321 1 N2Si3O6C21H42 A2B3C6D21E42 -434.38 5.97 -9.24 -0.38 0
22670 598326 3 SN2C8H14 AB2C8D14 -13.58 2.98 -8.66 -0.26 0
22671 598327 1 IC4H11 AB4C11 -13.99 1.2 -9.88 -0.82 0
22672 598328 1 SC4H6N6 AB4C6D6 128.08 4.37 -8.9 -0.95 0
22673 598329 1 NO4C10H17 AB4C10D17 -169.86 3.43 -9.23 -0.19 0
22674 598333 1 NOC11H23 ABC11D23 -94.92 1.78 -8.81 2.7 0
22675 598334 1 NS2O3C12H27 AB2C3D12E27 -165.27 4.61 -8.85 -1.32 0
22676 598336 2 O3C7H11 A3B7C11 -302.51 2.91 -10.77 0.64 0
22677 598337 1 O3C21H40 A3B21C40 -214.52 4.09 -9.93 0.7 0
22678 598338 1 NO4C15H33 AB4C15D33 -231.87 3.28 -9.28 1.54 0
22679 598339 1 NO5C16H35 AB5C16D35 -285.86 7.02 -9.8 1.36 0
22680 598347 1 OC16H20 AB16C20 14.4 2.58 -9.1 -0.11 0
22681 598348 1 SCl3O3H13C19 AB3C3D13E19 -91.39 5.73 -9.5 -1.56 0
22682 598349 2 NOH8C10 ABC8D10 70.96 3.45 -8.85 -1.44 0
22683 598360 2 NOC7H14 ABC7D14 -132.9 0.54 -9.31 1.16 0
22684 598361 1 SC10H18 AB10C18 -32.43 2.64 -8.38 0.79 0
22685 598362 1 SN2O5C15H22 AB2C5D15E22 -211.32 4.59 -9.65 -0.36 0
22686 598364 1 OC13H16 AB13C16 -21.33 2.24 -9.34 0.41 0
22687 598367 1 NOC15H27 ABC15D27 -84.15 3.37 -9.64 1.28 0
22688 598369 1 NO3C9H15 AB3C9D15 -114.42 2.13 -9.12 -0.27 0
22689 598370 1 NOC17H19 ABC17D19 -6.93 2.38 -8.47 -0.65 0
22690 598371 1 N3O3F4C9H9 A3B3C4D9E9 -291.78 3.67 -9.88 -0.58 0
22691 598372 1 NOC15H31 ABC15D31 -117.75 3.72 -9.62 1.42 0
22692 598373 1 NOC17H27 ABC17D27 -55.04 1.44 -8.58 0.34 0
22693 598374 1 N2H10C11 A2B10C11 57.83 1.78 -9.61 -0.72 0
22694 598375 1 ClSO2N3C13H14 ABC2D3E13F14 -40.85 9.42 -8.88 -0.89 0
22695 598376 1 N2H10C11 A2B10C11 57.84 1.93 -9.37 -0.77 0
22696 598377 1 O4N5C18H23 A4B5C18D23 -147.77 5.92 -8.93 -0.41 0
22697 598379 2 NO2C3H3 AB2C3D3 -85.41 6.87 -10.21 -1.46 0
22698 598380 2 NOC4H7 ABC4D7 -78.22 1.61 -8.86 0.59 0
22699 598381 1 NO3C14H27 AB3C14D27 -172.2 3.23 -8.85 1.04 0
22700 598382 2 ClNO2H5C7 ABC2D5E7 10.88 0.1 -9.95 -1.6 0
22701 598384 1 NO2C13H13 AB2C13D13 -45.17 5.18 -8.59 -0.78 0
22702 598385 1 NOC11H23 ABC11D23 -87.78 2.57 -8.51 2.6 0
22703 598386 1 O3H8C11 A3B8C11 -83.53 5.4 -9.43 -1.35 0
22704 598388 1 NOC13H15 ABC13D15 0.43 3.05 -8.36 -0.38 0
22705 598389 1 ON2H6C10 AB2C6D10 77.54 7.35 -9.39 -1.72 0
22706 598390 1 NO2F6H15C18 AB2C6D15E18 -357.25 4.76 -9.15 -0.59 0
22707 598391 2 NO2H7C9 AB2C7D9 -29.34 6.5 -9.17 -1.08 0
22708 598392 1 N2C13H16 A2B13C16 28.02 2.29 -8.09 0.32 0
22709 598395 1 NO2C16H23 AB2C16D23 -68.83 0.64 -9.28 0.3 0
22710 598396 1 SN2O3C8H10 AB2C3D8E10 -98.53 4.9 -9.59 -0.85 0
22711 598397 2 ON2C3H5 AB2C3D5 20.85 2.7 -9.43 -0.5 0
22712 598398 1 SiN2C8H18 AB2C8D18 -26.66 2.24 -8.16 1.36 0
22713 598399 1 NCl2O2H5C7 AB2C2D5E7 -1.32 4.92 -10.25 -1.73 0
22714 598401 1 N3O3C7H11 A3B3C7D11 -47.74 3.82 -9.26 -1.22 0
22715 598402 1 N3O3C7H11 A3B3C7D11 -35.72 6.44 -10.15 -1.1 0
22716 598403 1 SN2O3C20H40 AB2C3D20E40 -186.95 6.97 -8.6 0.44 0
22717 598404 1 OSN2C10H16 ABC2D10E16 -41.69 3.45 -8.95 -0.35 0
22718 598406 1 NOH11C12 ABC11D12 22.2 0.93 -8.99 -0.67 0
22719 598407 1 O3H16C18 A3B16C18 -19.31 5.03 -9.63 -1.01 0
22720 598408 1 NC28H39 AB28C39 16.56 2.35 -8.19 0.21 0
22721 598409 1 NC13H15 AB13C15 25.55 1.74 -9.16 -0.52 0
22722 598410 1 ClNSO2C12H16 ABCD2E12F16 -90.22 2.77 -9.09 -0.7 0
22723 598411 1 OSN2C7H10 ABC2D7E10 -31.53 3.63 -9.14 -0.67 0
22724 598412 1 N2O2S2C15H16 A2B2C2D15E16 -27.79 9.09 -8.02 -0.73 0
22725 598413 1 ClO2H7C8 AB2C7D8 -37.46 1.81 -9.09 -1.05 0
22726 598414 1 OSN2C7H10 ABC2D7E10 -31.67 2.06 -9.61 -0.63 0
22727 598415 1 N2H10C11 A2B10C11 72.26 4.84 -9.73 -0.58 0
22728 598416 1 SN4C6H10 AB4C6D10 46.16 1.74 -8.92 -0.33 0
22729 598417 2 OC6H6 AB6C6 -57.11 3.75 -9.14 -0.75 0
22730 598418 1 O2H10C13 A2B10C13 -39.16 5.47 -8.99 -1.03 0
22731 598419 1 NOC18H25 ABC18D25 -37.3 3.95 -9.14 0.23 0