List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
27423 821272 1 O3C20H28 A3B20C28 -150.31 5.8 -9.89 -0.63 0
27424 821304 1 NSO2C15H15 ABC2D15E15 -48.87 4.77 -8.65 -0.78 0
27425 821305 2 OC7H11 AB7C11 -92.87 4.0 -9.57 0.55 0
27426 821306 2 OC7H11 AB7C11 -92.87 4.01 -9.57 0.55 0
27427 821307 1 N2O2C17H18 A2B2C17D18 -53.19 3.47 -8.51 -0.26 0
27428 821309 1 O2C15H26 A2B15C26 -116.23 2.4 -9.67 2.51 0
27429 821310 1 O2C15H24 A2B15C24 -109.31 3.91 -9.76 0.87 0
27430 821311 1 N2O2C17H18 A2B2C17D18 -54.7 0.82 -8.25 -0.45 0
27431 821313 1 O2C15H24 A2B15C24 -103.08 4.65 -9.78 0.61 0
27432 821314 1 ON2C10H14 AB2C10D14 -41.99 3.13 -8.16 0.3 0
27433 821316 2 OC7H11 AB7C11 -104.21 4.23 -10.01 0.63 0
27434 821317 2 ClN2H5C7 AB2C5D7 105.48 5.08 -9.85 -1.36 0
27435 821319 1 O2C15H24 A2B15C24 -99.06 3.13 -9.73 0.64 0
27436 821322 1 O2C15H24 A2B15C24 -100.73 3.32 -9.64 0.73 0
27437 821325 1 O2C15H26 A2B15C26 -112.77 1.98 -9.66 2.48 0
27438 821327 2 N2C9H10 A2B9C10 97.95 8.65 -9.49 -0.89 0
27439 821330 2 OC7H11 AB7C11 -108.48 2.78 -9.93 0.62 0
27440 821345 1 NO4C20H21 AB4C20D21 -95.94 3.09 -8.1 -0.33 0
27441 821347 1 NO2C19H19 AB2C19D19 -22.94 1.63 -7.82 -0.29 0
27442 821350 1 ON5C17H21 AB5C17D21 38.67 5.24 -8.88 -0.86 0
27443 821362 1 O4C11H12 A4B11C12 -176.47 2.78 -9.4 -0.53 0
27444 821363 1 O3C15H26 A3B15C26 -180.69 3.16 -9.97 0.72 1
27445 821364 1 NO3C20H26 AB3C20D26 -69.28 5.16 0.0 0.0 1
27446 821365 1 NO3C20H26 AB3C20D26 -53.5 1.11 0.0 0.0 0
27447 821370 1 N2O2C19H22 A2B2C19D22 -38.18 6.13 -9.03 -0.18 1
27448 821379 1 NO4C20H24 AB4C20D24 -81.43 8.64 0.0 0.0 0
27449 821402 1 O4C15H22 A4B15C22 -126.15 6.16 -10.36 0.68 0
27450 821407 1 NOSC13H21 ABCD13E21 -68.43 8.08 -8.48 0.28 0
27451 821410 1 NOSC9H17 ABCD9E17 -63.33 2.01 -8.77 0.2 0
27452 821414 1 OSN2C13H22 ABC2D13E22 -79.71 8.43 -8.39 0.39 0
27453 821418 4 OC5H8 AB5C8 -210.35 3.9 -9.94 2.38 0
27454 821421 4 OC5H8 AB5C8 -214.0 4.38 -10.0 2.35 0
27455 821433 1 O5C15H18 A5B15C18 -195.89 6.42 -9.1 -0.9 0
27456 821434 1 O5C15H18 A5B15C18 -197.5 6.51 -9.22 -0.99 0
27457 821438 1 O2C15H24 A2B15C24 -114.55 3.71 -9.72 0.48 0
27458 821439 1 O4C17H24 A4B17C24 -188.12 3.63 -9.09 0.48 0
27459 821440 1 O4C17H24 A4B17C24 -188.01 3.65 -9.1 0.48 0
27460 821446 1 O6H18C19 A6B18C19 -71.08 8.25 -8.32 -1.07 0
27461 821447 1 O3C20H28 A3B20C28 -152.12 3.76 -8.72 0.0 0
27462 821455 1 O3C20H34 A3B20C34 -198.79 4.89 -9.86 2.52 0
27463 821456 1 O3C20H30 A3B20C30 -146.93 3.69 -9.3 0.58 0
27464 821457 1 O3C22H36 A3B22C36 -195.64 3.44 -10.1 0.77 0
27465 821459 1 O4C21H30 A4B21C30 -148.7 4.55 -9.97 0.57 0
27466 821463 1 ON3C20H21 AB3C20D21 36.08 4.35 -8.42 -0.78 0
27467 821500 1 SN3O4H11C15 AB3C4D11E15 -4.63 4.29 -9.12 -2.1 0
27468 821501 1 NS2C14H19 AB2C14D19 49.12 2.82 -7.94 -0.46 0
27469 821502 1 O4N5C14H15 A4B5C14D15 15.33 6.13 -9.39 -1.06 0
27470 821504 1 NS2C13H17 AB2C13D17 57.68 2.76 -7.96 -0.49 0
27471 821505 1 SO2N5H13C15 AB2C5D13E15 55.45 3.95 -8.71 -1.54 0
27472 821506 1 NOSC13H15 ABCD13E15 36.31 2.42 -8.19 -0.18 0
27473 821509 1 NSC13H15 ABC13D15 67.43 3.02 -8.0 -0.32 0
27474 821511 1 N3O3H17C18 A3B3C17D18 -30.38 3.64 -8.61 -0.75 0
27475 821523 1 SO4C6H8 AB4C6D8 -178.53 3.5 -10.12 -1.1 0
27476 821526 1 ClN2O2H11C13 AB2C2D11E13 -29.01 4.84 -9.01 -0.84 0
27477 821552 1 NO3C18H21 AB3C18D21 -110.22 2.96 -8.92 0.03 0
27478 821553 2 ClOH6C8 ABC6D8 -44.12 4.43 -9.12 -1.05 0
27479 821555 2 ClOH6C8 ABC6D8 -43.93 4.45 -9.15 -1.06 0
27480 821556 1 NO3H11C15 AB3C11D15 -53.34 4.31 -9.56 -1.4 0
27481 821558 1 NO2C17H19 AB2C17D19 -73.11 2.95 -9.31 0.0 0
27482 821573 1 ON2H12C20 AB2C12D20 83.29 2.99 -9.07 -1.26 0
27483 821575 1 NO2C11H17 AB2C11D17 -91.7 3.26 -9.57 -0.23 0
27484 821578 1 ClNO3H10C11 ABC3D10E11 -105.0 8.35 -9.91 -0.7 0
27485 821579 1 ClON2H11C16 ABC2D11E16 48.74 5.36 -9.77 -0.86 0
27486 821581 1 ON2Cl4C12H14 AB2C4D12E14 -62.53 3.81 -9.79 -0.64 0
27487 821596 1 Cl2N3O3H7C12 A2B3C3D7E12 5.95 3.23 -9.71 -2.1 0
27488 821598 1 ClN2O5H11C15 AB2C5D11E15 -87.03 6.85 -8.9 -1.88 0
27489 821601 1 SN2O2C11H12 AB2C2D11E12 -32.79 3.57 -9.1 -0.49 0
27490 821602 1 OSN2H14C16 ABC2D14E16 21.47 5.51 -8.98 -0.64 0
27491 821619 1 NO3C12H17 AB3C12D17 -134.7 4.41 -9.21 -0.01 0
27492 821620 1 OSN3H9C10 ABC3D9E10 35.67 2.41 -9.58 -1.28 0
27493 821622 1 OCl3N3C11H14 AB3C3D11E14 -42.39 4.16 -9.96 -0.59 0
27494 821623 1 FN2O2H11C13 AB2C2D11E13 -36.02 4.89 -9.51 -0.58 0
27495 821625 1 SN3O3C11H11 AB3C3D11E11 -36.21 9.57 -9.37 -0.85 0
27496 821627 1 SO3N5H11C14 AB3C5D11E14 95.14 1.28 -8.84 -1.64 0
27497 821629 1 OSN4H10C11 ABC4D10E11 77.14 7.67 -9.28 -1.23 0
27498 821662 1 SN2C13H18 AB2C13D18 14.54 1.74 -8.25 0.09 0
27499 821665 1 NS2O5H11C14 AB2C5D11E14 -74.1 4.22 -9.03 -1.26 0
27500 821666 1 ClO2N3H16C17 AB2C3D16E17 -29.71 4.49 -8.7 -0.56 0
27501 821667 1 ON3C13H17 AB3C13D17 -7.24 4.55 -8.81 -0.42 0
27502 821674 1 FNO2S2C15H18 ABC2D2E15F18 -101.94 5.23 -8.59 -0.51 0
27503 821681 1 BrSO2C8H9 ABC2D8E9 -58.93 2.98 -9.26 -0.65 0
27504 821687 1 NSO3C8H9 ABC3D8E9 -108.84 3.08 -8.84 -0.9 0
27505 821688 1 NSO4H7C10 ABC4D7E10 -40.64 4.53 -9.52 -1.94 0
27506 821689 1 BrSO2H7C11 ABC2D7E11 -25.77 5.8 -9.17 -1.46 0
27507 821693 1 SO2N4C10H10 AB2C4D10E10 5.85 3.02 -9.17 -1.34 0
27508 821699 1 BrOCl2H3C6 ABC2D3E6 -29.74 2.64 -9.56 -0.87 0
27509 821700 1 NO4H13C15 AB4C13D15 -49.57 5.32 -9.86 -1.07 0
27510 821707 1 SN2O3C13H16 AB2C3D13E16 -102.17 2.44 -9.45 -0.44 0
27511 821717 1 SN2O2H16C17 AB2C2D16E17 -24.7 5.13 -9.39 -0.79 0
27512 821719 1 ClNSC14H16 ABCD14E16 18.1 1.37 -8.65 -0.65 0
27513 821739 1 NSC11H11 ABC11D11 51.43 1.18 -8.85 -0.34 0
27514 821759 1 SO2N3C12H13 AB2C3D12E13 -17.72 3.3 -8.37 -0.59 0
27515 821762 1 FON2Cl3C8H12 ABC2D3E8F12 -118.99 2.79 -9.47 -0.5 0
27516 821768 1 BrOC17H17 ABC17D17 -7.79 2.72 -9.49 -0.84 0
27517 821772 1 ON2Cl3C15H17 AB2C3D15E17 -26.11 3.64 -9.46 -0.41 0
27518 821774 1 ON2Cl3C15H17 AB2C3D15E17 -31.07 5.01 -9.31 -0.79 0
27519 821777 1 O3H16C17 A3B16C17 -85.9 7.77 -9.71 -1.16 0
27520 821779 1 O3H16C17 A3B16C17 -83.99 3.98 -9.74 -0.62 0
27521 821784 1 ON2Cl3C13H17 AB2C3D13E17 -63.85 4.98 -9.56 -0.41 0
27522 821787 1 OSC16H16 ABC16D16 -0.5 3.72 -8.65 -0.59 0