List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
55401 17395337 1 N2O3C21H26 A2B3C21D26 -78.5 4.5 -7.98 -0.42 0
55402 17395338 1 SN2O2C18H20 AB2C2D18E20 -45.6 2.2 -8.95 -0.5 0
55403 17395341 1 O2N3C18H19 A2B3C18D19 -24.53 5.86 -9.04 -0.29 0
55404 17395342 1 SN2O3C13H18 AB2C3D13E18 -111.76 9.1 -9.68 -0.66 0
55405 17395343 1 N3O3C17H23 A3B3C17D23 -144.95 5.92 -8.67 -0.07 0
55406 17395345 1 SO2N3C18H19 AB2C3D18E19 -18.44 4.8 -8.9 -1.16 0
55407 17395348 1 N3O4C19H25 A3B4C19D25 -178.15 1.66 -8.56 0.0 0
55408 17395349 1 SF2O2N3H15C17 AB2C2D3E15F17 -82.23 6.62 -9.36 -1.02 0
55409 17395350 1 ClSO2N3H16C17 ABC2D3E16F17 -1.65 5.15 -9.3 -0.86 0
55410 17395351 1 SO2N3C19H21 AB2C3D19E21 -14.03 6.1 -9.19 -0.22 0
55411 17395352 1 FSO2N3H16C17 ABC2D3E16F17 -39.38 5.0 -9.33 -0.69 0
55412 17395353 1 SN3O4C15H19 AB3C4D15E19 -78.88 9.29 -9.25 -0.58 0
55413 17395354 1 SN2O5C16H20 AB2C5D16E20 -165.47 8.63 -9.02 -0.72 0
55414 17395355 1 BrN2O4H13C14 AB2C4D13E14 -94.08 1.56 -8.52 -0.9 0
55415 17395356 1 SN2O4C20H26 AB2C4D20E26 -143.79 4.83 -8.16 -0.87 0
55416 17395362 1 OSN5C19H27 ABC5D19E27 -12.13 0.73 -8.69 -0.84 0
55417 17395363 1 SN3O3C17H23 AB3C3D17E23 -103.05 7.92 -9.46 -0.82 0
55418 17395367 1 OF3N4C15H21 AB3C4D15E21 -188.93 7.42 -8.81 -0.39 0
55419 17395368 1 SO2N4H16C18 AB2C4D16E18 68.91 2.24 -8.71 -0.75 0
55420 17395369 1 N2O5C16H18 A2B5C16D18 -134.2 3.42 -9.36 -0.95 0
55421 17395372 1 SN2O4C13H14 AB2C4D13E14 -89.5 2.41 -9.58 -1.3 0
55422 17395376 1 N3O4C17H17 A3B4C17D17 -75.46 6.62 -8.91 -0.41 0
55423 17395383 1 N3O3C17H19 A3B3C17D19 -63.59 6.17 -8.79 -0.29 0
55424 17395384 1 N3O4C17H17 A3B4C17D17 -88.19 5.22 -9.12 -1.02 0
55425 17395385 1 BrN2O3H13C17 AB2C3D13E17 -57.03 6.83 -9.11 -1.48 0
55426 17395386 1 ClSN2O3H11C15 ABC2D3E11F15 -57.03 7.03 -9.07 -1.72 0
55427 17395387 1 FO3N5H12C15 AB3C5D12E15 -52.86 3.95 -8.92 -0.64 0
55428 17395388 1 N2O4C15H16 A2B4C15D16 -86.7 3.96 -9.55 -0.71 0
55429 17395389 2 N3C10H15 A3B10C15 47.56 2.07 -8.51 0.04 0
55430 17395390 1 ClO2N4C19H23 AB2C4D19E23 -32.41 2.78 -9.09 -1.1 0
55431 17395391 1 ClSN2O3C15H19 ABC2D3E15F19 -101.58 4.36 -9.24 -1.02 0
55432 17395392 1 ClSN2O3C15H19 ABC2D3E15F19 -94.44 4.04 -9.2 -1.04 0
55433 17395393 2 NOC7H9 ABC7D9 -52.47 3.84 -9.57 -0.73 0
55434 17395394 1 SN3O3C17H21 AB3C3D17E21 -91.32 4.8 -9.11 -1.16 0
55435 17395395 1 N3O4C17H27 A3B4C17D27 -214.68 1.96 -9.42 -0.2 0
55436 17395396 1 N2O3C14H20 A2B3C14D20 -127.69 1.95 -9.26 0.01 0
55437 17395397 1 SN3O3H17C19 AB3C3D17E19 -39.88 3.84 -9.32 -1.0 0
55438 17395398 1 NO3C21H21 AB3C21D21 -59.3 3.23 -8.96 -0.19 0
55439 17395399 1 N2O2C15H22 A2B2C15D22 -100.49 1.2 -9.31 0.13 0
55440 17395400 1 N2O3C22H24 A2B3C22D24 -66.44 4.28 -8.74 -0.11 0
55441 17395401 1 SN2O2C19H24 AB2C2D19E24 -56.64 5.93 -8.85 -0.94 0
55442 17395402 1 SO2N3C15H19 AB2C3D15E19 -53.41 3.54 -8.34 -0.53 0
55443 17395403 1 F2N2O3H14C19 A2B2C3D14E19 -136.77 5.09 -9.24 -0.99 0
55444 17395404 1 FN2S2O3C16H23 AB2C2D3E16F23 -169.16 3.3 -8.94 -0.86 0
55445 17395405 1 N2O3S3C14H22 A2B3C3D14E22 -112.3 3.13 -8.88 -1.03 0
55446 17395406 1 OSN3C16H19 ABC3D16E19 2.29 2.93 -9.06 -0.98 0
55447 17395407 1 ON5C20H27 AB5C20D27 -11.51 6.54 -9.76 -0.88 0
55448 17395408 1 FN2O2H13C14 AB2C2D13E14 -75.29 1.67 -8.98 -0.6 0
55449 17395409 1 FN2O2H13C14 AB2C2D13E14 -72.39 4.68 -9.17 -0.65 0
55450 17395411 1 BrN2O3C15H15 AB2C3D15E15 -66.78 4.68 -9.06 -0.43 0
55451 17395412 1 BrN2O3C16H17 AB2C3D16E17 -67.75 6.12 -9.09 -0.45 0
55452 17395413 1 ON5H17C20 AB5C17D20 89.3 3.04 -9.03 -0.81 0
55453 17395415 1 ON5H15C19 AB5C15D19 104.71 3.02 -9.35 -0.82 0
55454 17395416 2 ON2H9C10 AB2C9D10 38.04 6.87 -9.29 -0.48 0
55455 17395417 1 SO3N4H16C17 AB3C4D16E17 19.61 4.57 -8.94 -1.38 0
55456 17395418 1 O3N4C20H20 A3B4C20D20 -84.7 2.45 -9.43 -0.49 0
55457 17395419 1 BrN2O2C15H15 AB2C2D15E15 -28.52 4.12 -9.15 -0.43 0
55458 17395420 1 BrN2O2H13C14 AB2C2D13E14 -24.71 4.69 -9.15 -0.67 0
55459 17395421 3 NOH5C6 ABC5D6 -33.31 4.09 -9.06 -1.02 0
55460 17395422 1 O2N3C16H17 A2B3C16D17 -52.95 2.81 -8.6 -0.34 0
55461 17395423 1 BrN2O2H13C14 AB2C2D13E14 -30.44 3.91 -9.12 -0.53 0
55462 17395424 3 NOH5C6 ABC5D6 -39.0 5.96 -9.01 -1.03 0
55463 17395425 1 O2N4C19H20 A2B4C19D20 -35.8 6.97 -8.69 -0.36 0
55464 17395426 2 NOC8H9 ABC8D9 -41.62 4.42 -8.85 -0.17 0
55465 17395427 1 N2O3C19H24 A2B3C19D24 -104.34 5.13 -8.44 0.29 0
55466 17395428 2 NOH8C9 ABC8D9 0.46 4.47 -8.54 -0.84 0
55467 17395429 1 OS2N3C18H19 AB2C3D18E19 39.9 3.91 -8.17 -1.08 0
55468 17395430 1 N3O3C16H17 A3B3C16D17 -81.57 2.29 -9.29 -0.53 0
55469 17395431 1 N4O5C22H24 A4B5C22D24 -131.39 6.34 -8.68 -0.7 0
55470 17395432 1 N3O3C17H17 A3B3C17D17 -18.0 6.01 -9.06 -0.92 0
55471 17395433 1 BrNSO2C15H16 ABCD2E15F16 -32.21 3.12 -9.58 -0.37 0
55472 17395434 1 N2O3H14C15 A2B3C14D15 -65.81 2.32 -9.6 -0.33 0
55473 17395436 1 OF3N3C17H24 AB3C3D17E24 -211.95 7.98 -8.89 -0.43 0
55474 17395437 1 OSN3C18H21 ABC3D18E21 31.56 3.63 -8.5 -0.73 0
55475 17395438 1 N2O3C22H22 A2B3C22D22 -52.07 6.72 -9.2 -1.66 0
55476 17395439 1 SN3O3H17C18 AB3C3D17E18 -30.57 5.95 -8.92 -0.45 0
55477 17395440 1 ClN2O3C16H19 AB2C3D16E19 -120.06 5.68 -9.24 -0.81 0
55478 17395441 2 ClNOC7H9 ABCD7E9 -104.03 3.01 -9.59 -1.01 0
55479 17395442 1 O2N4C17H22 A2B4C17D22 -42.81 1.22 -9.24 -0.58 0
55480 17395443 1 OF3N3C16H16 AB3C3D16E16 -147.43 4.72 -9.33 -0.43 0
55481 17395444 1 ON3C16H19 AB3C16D19 8.38 4.75 -9.0 -0.19 0
55482 17395445 1 ClFN2O2C17H24 ABC2D2E17F24 -149.87 0.42 -8.92 -0.79 0
55483 17395446 1 N3O3H17C19 A3B3C17D19 -9.03 3.48 -8.71 -0.7 0
55484 17395447 1 NSO4C19H21 ABC4D19E21 -121.94 2.75 -9.24 -0.29 0
55485 17395448 1 O2N4C19H20 A2B4C19D20 -14.34 3.43 -8.21 -0.89 0
55486 17395449 1 O2N3H17C18 A2B3C17D18 -22.74 1.56 -9.39 -0.98 0
55487 17395450 1 NSO3H9C13 ABC3D9E13 -24.08 3.99 -8.97 -1.7 0
55488 17395451 1 NO2S2H9C13 AB2C2D9E13 12.03 3.97 -9.02 -1.69 0
55489 17395452 1 ClO2N3C20H22 AB2C3D20E22 -48.97 1.81 -8.73 -0.14 0
55490 17395453 1 SN3O3H17C19 AB3C3D17E19 -15.66 1.48 -9.24 -1.26 0
55491 17395454 1 ON2S2C13H16 AB2C2D13E16 -5.97 4.08 -9.21 -1.4 0
55492 17395455 1 O2S2N4H12C15 A2B2C4D12E15 33.57 2.23 -9.39 -1.64 0
55493 17395456 1 ClN3O3C15H18 AB3C3D15E18 -131.68 8.67 -8.82 -0.48 0
55494 17395457 1 ClN3O4C15H18 AB3C4D15E18 -157.62 2.63 -8.6 -0.35 0
55495 17395459 1 N2O3C21H24 A2B3C21D24 -89.43 5.76 -8.61 -0.25 0
55496 17395460 1 N2O3C19H22 A2B3C19D22 -93.32 2.32 -9.3 -0.62 0
55497 17395462 1 OSN4C20H28 ABC4D20E28 -22.99 8.57 -8.46 -0.55 0
55498 17395469 1 ClNO5C12H14 ABC5D12E14 -184.47 3.18 -8.91 -0.66 0
55499 17395470 1 O2N4C19H20 A2B4C19D20 -18.24 3.05 -9.26 -0.72 0
55500 17395472 1 N3O3H19C21 A3B3C19D21 -36.26 1.4 -9.14 -0.92 0