List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
362289 127307311 1 N3O3C22H35 A3B3C22D35 -139.64 4.18 -8.78 -0.05 0
362290 127307312 1 O2N5C19H31 A2B5C19D31 -73.07 3.06 -8.41 -0.1 0
362291 127307313 1 O2N5C20H33 A2B5C20D33 -67.0 2.77 -8.52 0.2 0
362292 127307314 1 ON5C16H33 AB5C16D33 -65.33 4.1 -8.59 1.51 0
362293 127307315 1 ON5C16H33 AB5C16D33 -61.15 4.07 -8.59 1.51 0
362294 127307316 1 O2N5C15H29 A2B5C15D29 -100.5 1.72 -8.45 0.78 0
362295 127307317 2 ON3C9H15 AB3C9D15 -60.68 3.45 -8.5 -0.07 0
362296 127307318 1 ON6C18H28 AB6C18D28 4.2 3.47 -8.47 -0.04 0
362297 127307319 1 ON6C17H28 AB6C17D28 0.86 4.57 -8.56 0.07 0
362298 127307320 1 N2O3C13H24 A2B3C13D24 -160.27 2.55 -9.26 0.94 0
362299 127307321 1 N2O2C13H22 A2B2C13D22 -91.9 3.58 -9.37 0.97 0
362300 127307322 1 ON5C23H31 AB5C23D31 9.2 3.83 -8.62 0.05 0
362301 127307323 1 ON6C18H30 AB6C18D30 -23.67 2.24 -8.42 0.1 0
362302 127307324 1 OF3N5C15H28 AB3C5D15E28 -217.92 6.33 -8.52 1.04 0
362303 127307325 2 ON2C10H15 AB2C10D15 -102.88 5.3 -8.8 -0.14 0
362304 127307326 1 ON6C16H28 AB6C16D28 -19.09 6.12 -8.34 0.76 0
362305 127307327 1 ON6C15H28 AB6C15D28 -20.61 2.88 -8.61 0.72 0
362306 127307328 1 ON6C14H26 AB6C14D26 -18.22 8.28 -8.78 0.7 0
362307 127307329 1 ON6C15H28 AB6C15D28 -12.07 3.86 -8.74 0.74 0
362308 127307330 1 ClN3O4C16H20 AB3C4D16E20 -150.57 3.25 -9.1 -0.44 0
362309 127307331 1 N3O3C20H29 A3B3C20D29 -114.34 2.99 -8.31 0.34 0
362310 127307339 1 SO2N5C17H33 AB2C5D17E33 -91.92 3.68 -8.5 0.44 0
362311 127307340 1 ON5C18H37 AB5C18D37 -70.6 5.11 -8.54 1.37 0
362312 127307341 1 O2N3C18H25 A2B3C18D25 -67.92 1.43 -8.73 0.03 0
362313 127307342 1 SO3N4C19H30 AB3C4D19E30 -108.66 4.52 -8.86 0.27 0
362314 127307343 1 SO3N5C14H29 AB3C5D14E29 -139.86 6.26 -8.59 0.45 0
362315 127307344 1 SN4O4C17H26 AB4C4D17E26 -167.69 4.73 -9.58 -0.27 0
362316 127307345 1 O2N5C14H25 A2B5C14D25 -43.49 7.28 -8.71 0.17 0
362317 127307346 1 ON5C19H37 AB5C19D37 -74.68 2.35 -8.4 1.28 0
362318 127307347 1 O2N5C14H27 A2B5C14D27 -88.21 3.26 -8.52 0.42 0
362319 127307348 1 F2O2N4C19H26 A2B2C4D19E26 -172.64 7.67 -9.12 -0.51 0
362320 127307349 1 O3N4C20H32 A3B4C20D32 -109.04 5.49 -8.56 0.09 0
362321 127307350 1 SN3O4C13H25 AB3C4D13E25 -193.85 8.79 -8.63 0.02 0
362322 127307351 1 O2N5C17H33 A2B5C17D33 -114.59 2.98 -8.31 0.95 0
362323 127307352 2 ON2C10H16 AB2C10D16 -78.09 4.01 -8.45 0.23 0
362324 127307353 1 O2N5C13H23 A2B5C13D23 -28.74 6.55 -8.72 -0.35 0
362325 127307354 1 O2N3C17H23 A2B3C17D23 -65.54 6.13 -8.93 -0.23 0
362326 127307355 1 O2N5C17H33 A2B5C17D33 -111.77 3.04 -8.44 0.94 0
362327 127307356 1 O2N4C15H30 A2B4C15D30 -108.97 5.56 -8.7 1.32 0
362328 127307357 1 FN3O3C22H26 AB3C3D22E26 -122.26 4.62 -8.88 -0.47 0
362329 127307358 1 FO3N4C17H25 AB3C4D17E25 -149.5 2.18 -8.48 -0.47 0
362330 127307368 1 O2N4C15H30 A2B4C15D30 -105.28 3.93 -8.43 1.39 0
362331 127307369 1 N3O3C14H27 A3B3C14D27 -147.98 5.33 -9.05 1.01 0
362332 127307373 1 OSN5C17H31 ABC5D17E31 -39.68 4.4 -8.62 -0.45 0
362333 127307374 1 SN3O3C11H21 AB3C3D11E21 -128.88 7.11 -9.32 0.26 0
362334 127307375 2 NOC6H11 ABC6D11 -106.65 3.46 -9.16 1.01 0
362335 127307376 1 ON2C12H20 AB2C12D20 -41.27 3.61 -9.37 1.04 0
362336 127307377 1 O2N3C14H23 A2B3C14D23 -103.77 2.38 -9.06 1.07 0
362337 127307378 1 OSN5C14H25 ABC5D14E25 -21.33 4.68 -8.57 -0.5 0
362338 127307379 1 ClO2N5C18H26 AB2C5D18E26 -71.33 4.08 -8.64 -0.24 0
362339 127307380 1 FON6C20H29 ABC6D20E29 -40.0 3.15 -8.52 -0.9 0
362340 127307405 1 O3N5C15H29 A3B5C15D29 -129.54 5.26 -8.46 0.52 0
362341 127307406 1 O2N5C20H37 A2B5C20D37 -111.46 5.5 -8.6 1.02 0
362342 127307407 1 O2N5C17H33 A2B5C17D33 -110.61 4.2 -8.41 0.87 0
362343 127307409 1 O2N5C16H31 A2B5C16D31 -112.27 2.42 -8.45 0.83 0
362344 127307410 1 O2N5C21H33 A2B5C21D33 -77.94 5.75 -8.37 0.06 0
362345 127307411 1 FO3N4C18H27 AB3C4D18E27 -156.38 1.81 -8.44 -0.41 0
362346 127307412 1 O2N6C15H24 A2B6C15D24 -50.7 2.48 -8.55 -0.5 0
362347 127307413 2 ON3C10H19 AB3C10D19 -103.01 8.17 -8.62 1.02 0
362348 127307414 1 O2N5C20H31 A2B5C20D31 -75.65 1.56 -8.37 -0.04 0
362349 127307415 1 O2N5C18H35 A2B5C18D35 -112.09 1.74 -8.54 1.23 0
362350 127307419 2 ON3C10H19 AB3C10D19 -103.17 1.36 -8.38 0.92 0
362351 127307420 1 OSN6C17H30 ABC6D17E30 -6.76 3.87 -8.53 -0.44 0
362352 127307421 2 ON3C9H17 AB3C9D17 -93.51 6.45 -8.4 0.76 0
362353 127307422 1 OSN6C16H28 ABC6D16E28 -6.08 3.15 -8.39 -0.56 0
362354 127307425 1 OSN4C13H26 ABC4D13E26 -53.28 3.86 -8.62 0.54 0
362355 127307426 1 ON5C16H27 AB5C16D27 -15.47 3.42 -8.57 -0.17 0
362356 127307447 1 ON6C16H28 AB6C16D28 -7.67 5.2 -8.3 0.94 0
362357 127307448 1 OSN5C13H23 ABC5D13E23 -8.17 4.08 -8.47 -0.56 0
362358 127307449 1 O2N5C17H35 A2B5C17D35 -105.32 2.87 -8.58 1.23 0
362359 127307450 1 O2N5C17H33 A2B5C17D33 -104.52 6.3 -8.67 0.94 0
362360 127307451 2 ON2C7H14 AB2C7D14 -101.65 3.91 -8.54 1.19 0
362361 127307452 1 O2N5C18H37 A2B5C18D37 -113.76 4.32 -8.63 1.21 0
362362 127307453 1 O2N5C21H35 A2B5C21D35 -65.6 1.21 -8.5 0.2 0
362363 127307454 1 O2N5C16H27 A2B5C16D27 -35.81 5.32 -8.44 -0.17 0
362364 127307455 1 OSN4C12H24 ABC4D12E24 -50.04 3.48 -8.43 0.61 0
362365 127307456 1 O2N5C20H37 A2B5C20D37 -124.22 5.39 -8.44 1.13 0
362366 127307457 1 SO2N5C19H31 AB2C5D19E31 -76.54 7.75 -8.65 -0.71 0
362367 127307458 1 ON5C16H27 AB5C16D27 -16.12 5.15 -8.6 -0.17 0
362368 127307459 1 SO2N5C18H29 AB2C5D18E29 -77.0 0.89 -9.03 -0.51 0
362369 127307460 1 SN3O3C17H25 AB3C3D17E25 -101.57 4.98 -9.2 0.19 0
362370 127307461 1 SN2O5C18H26 AB2C5D18E26 -200.66 7.15 -9.67 -0.19 0
362371 127307462 1 N2O3C22H32 A2B3C22D32 -126.34 4.93 -9.38 0.14 0
362372 127307463 1 N2O3C20H28 A2B3C20D28 -115.21 3.2 -9.36 0.1 0
362373 127307464 1 SO2N4C19H20 AB2C4D19E20 -23.57 7.51 -8.74 -0.78 0
362374 127307465 1 ON5C19H23 AB5C19D23 25.31 1.44 -8.88 -0.48 0
362375 127307466 1 O2N4C19H26 A2B4C19D26 -77.04 3.61 -9.12 0.22 0
362376 127307469 1 ON3C17H21 AB3C17D21 -13.13 4.71 -9.39 0.01 0
362377 127307470 1 SN4O4C17H28 AB4C4D17E28 -162.31 5.56 -9.1 0.13 0
362378 127307471 1 O3N5C19H31 A3B5C19D31 -124.73 4.98 -8.81 0.44 0
362379 127307485 1 SN2O3C19H22 AB2C3D19E22 -102.05 4.5 -9.02 -0.13 0
362380 127307725 1 O3N4C17H22 A3B4C17D22 -65.2 5.88 -8.63 -0.96 0
362381 127307726 1 O3N4C13H22 A3B4C13D22 -140.69 2.5 -8.88 -0.21 0
362382 127307727 1 O2N4C17H22 A2B4C17D22 -21.44 8.04 -8.68 -0.96 0
362383 127307728 1 O2N4C15H18 A2B4C15D18 -18.64 5.48 -8.8 -0.84 0
362384 127307729 1 O2N3C16H17 A2B3C16D17 -9.9 7.52 -9.1 -0.92 0
362385 127307730 1 O3N4C14H24 A3B4C14D24 -147.28 2.03 -8.84 -0.25 0
362386 127307731 1 O3N4C13H22 A3B4C13D22 -134.49 4.03 -8.96 -0.3 0
362387 127307732 2 ON2C9H12 AB2C9D12 -29.01 6.79 -8.83 -0.82 0
362388 127307733 1 O2N4C15H24 A2B4C15D24 -77.31 1.92 -9.1 -0.14 0