List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
371242 127344462 1 O2N4C17H20 A2B4C17D20 -30.86 2.77 -8.89 0.08 0
371243 127344463 1 N2O3C18H26 A2B3C18D26 -137.44 3.82 -8.84 0.12 0
371244 127344464 1 N3O3C18H25 A3B3C18D25 -137.0 2.34 -8.89 0.06 0
371245 127344465 1 ClO2N5C19H22 AB2C5D19E22 -37.74 1.23 -8.95 -0.33 0
371246 127344467 1 ON6C18H26 AB6C18D26 -4.94 3.77 -8.97 0.31 0
371247 127344468 1 O2N4C19H32 A2B4C19D32 -112.52 6.68 -8.67 0.82 0
371248 127344469 1 ON5C22H37 AB5C22D37 -58.36 4.04 -8.69 1.03 0
371249 127344470 1 ON6C22H34 AB6C22D34 -20.32 6.59 -8.65 0.58 0
371250 127344471 1 ON5C22H37 AB5C22D37 -57.71 1.95 -8.78 0.87 0
371251 127344472 1 O2N5C18H29 A2B5C18D29 -96.16 3.29 -8.72 0.49 0
371252 127344473 1 ON6C21H32 AB6C21D32 -13.96 2.84 -8.73 0.64 0
371253 127344474 1 O2N5C18H29 A2B5C18D29 -85.43 8.8 -8.56 0.37 0
371254 127344475 1 OSN4C17H28 ABC4D17E28 -53.52 1.05 -8.78 0.45 0
371255 127344476 1 ON4C19H30 AB4C19D30 -51.47 2.59 -8.74 0.9 0
371256 127344478 1 O2N5C17H27 A2B5C17D27 -87.28 2.94 -8.81 0.38 0
371257 127344479 1 FO2N4C16H17 AB2C4D16E17 -72.44 6.29 -9.23 -0.6 0
371258 127344480 1 SO3N4C16H32 AB3C4D16E32 -145.42 5.22 -8.74 0.22 0
371259 127344562 1 ON5C21H29 AB5C21D29 -9.06 2.51 -9.53 -0.03 0
371260 127344582 1 ON4C15H24 AB4C15D24 -27.27 4.03 -9.42 0.66 0
371261 127344583 1 O2N4C21H30 A2B4C21D30 -56.07 3.07 -9.01 -0.13 0
371262 127344610 1 ON4C20H34 AB4C20D34 -52.39 5.15 -9.26 0.76 0
371263 127344618 2 ON3C10H17 AB3C10D17 -103.97 1.18 -9.63 0.44 0
371264 127344619 1 O2N5C19H31 A2B5C19D31 -94.0 6.43 -9.34 0.67 0
371265 127344620 1 O2N5C20H33 A2B5C20D33 -94.44 6.04 -9.41 0.76 0
371266 127344621 1 OF2N4C16H16 AB2C4D16E16 -55.21 7.91 -9.23 -0.57 0
371267 127344623 1 FON5C18H22 ABC5D18E22 -39.42 2.8 -8.45 0.27 0
371268 127344624 1 FON5C21H28 ABC5D21E28 -47.45 2.53 -8.61 0.02 0
371269 127344625 1 ON5C18H31 AB5C18D31 -46.51 7.72 -9.38 0.66 0
371270 127344626 1 ON6C19H32 AB6C19D32 -27.03 8.23 -8.88 0.66 0
371271 127344632 1 O2N5C22H31 A2B5C22D31 -33.94 6.55 -7.95 0.64 0
371272 127344633 1 FON5C19H24 ABC5D19E24 -42.34 2.35 -8.55 0.12 0
371273 127344637 1 FON5C22H30 ABC5D22E30 -49.83 5.98 -8.64 0.11 0
371274 127344638 1 O2N7C15H19 A2B7C15D19 0.59 6.35 -8.78 0.02 0
371275 127344639 2 ON4C9H13 AB4C9D13 -15.5 2.51 -8.7 0.09 0
371276 127344640 1 OSN4C15H16 ABC4D15E16 20.45 6.12 -8.78 -0.37 0
371277 127344642 1 OSN4C18H22 ABC4D18E22 12.11 5.38 -8.53 -0.17 0
371278 127344648 1 O2N5C19H33 A2B5C19D33 -90.1 5.03 -9.45 0.61 0
371279 127344649 1 O2N4C21H36 A2B4C21D36 -97.71 6.81 -9.18 0.72 0
371280 127344670 1 O2N5C17H27 A2B5C17D27 -60.81 3.1 -8.97 0.44 0
371281 127344677 1 OSN2C12H20 ABC2D12E20 -52.49 3.19 -8.69 0.61 0
371282 127344678 1 O4N5C16H27 A4B5C16D27 -183.54 5.31 -9.14 0.52 0
371283 127345461 1 SN2O2C15H18 AB2C2D15E18 -59.5 4.73 -8.77 -0.55 0
371284 127345462 1 ClSN2O5C16H21 ABC2D5E16F21 -193.37 8.58 -9.24 -0.99 0
371285 127345463 1 SN2O2C10H14 AB2C2D10E14 -61.84 3.31 -9.14 -0.56 0
371286 127345464 1 SN2O2C14H16 AB2C2D14E16 -49.36 5.09 -8.91 -0.63 0
371287 127345468 1 SN2O4C18H26 AB2C4D18E26 -167.87 10.37 -9.12 -0.62 0
371288 127345469 1 SN2O4C19H28 AB2C4D19E28 -169.37 7.99 -9.1 -0.55 0
371289 127345470 1 SN2O4C18H26 AB2C4D18E26 -164.64 8.6 -9.05 -0.62 0
371290 127345491 1 SN2O2C10H14 AB2C2D10E14 -71.84 1.06 -8.95 -0.36 0
371291 127345492 1 SN2O4C20H24 AB2C4D20E24 -129.81 6.5 -9.28 -1.18 0
371292 127345493 1 ClSN2O4C16H21 ABC2D4E16F21 -155.48 4.78 -9.39 -1.14 0
371293 127345541 1 SN2O2C18H20 AB2C2D18E20 -39.75 2.44 -8.63 -0.7 0
371294 127345542 1 SN2O5C18H26 AB2C5D18E26 -201.25 6.02 -8.86 -0.6 0
371295 127345543 1 N2O3C16H20 A2B3C16D20 -118.28 8.93 -8.29 -0.07 0
371296 127345556 1 SN2O4C13H18 AB2C4D13E18 -125.25 7.19 -9.83 -0.51 0
371297 127345557 1 N2O3C12H20 A2B3C12D20 -122.51 3.45 -9.6 0.45 0
371298 127345576 1 O3N5C18H19 A3B5C18D19 -57.72 5.23 -8.54 -0.98 0
371299 127345577 1 SO3N4C13H14 AB3C4D13E14 -46.09 4.25 -9.68 -1.29 0
371300 127345582 1 ON4C19H24 AB4C19D24 6.68 5.09 -9.39 -1.01 0
371301 127345583 2 NOC8H12 ABC8D12 -97.3 1.85 -9.56 -0.2 0
371302 127345653 1 O2N3C11H17 A2B3C11D17 -60.36 2.66 -9.12 0.22 0
371303 127345654 1 ON4C20H24 AB4C20D24 20.47 4.09 -9.38 -0.92 0
371304 127345655 1 ON4C19H22 AB4C19D22 30.67 4.82 -9.43 -1.04 0
371305 127345656 1 ClN2O3C18H25 AB2C3D18E25 -123.75 3.94 -8.8 -0.49 0
371306 127345657 1 O2N3C17H21 A2B3C17D21 -42.3 5.05 -8.88 -0.42 0
371307 127345658 1 NSO4C17H23 ABC4D17E23 -165.09 6.1 -9.62 -0.71 0
371308 127345659 1 N2O3C15H18 A2B3C15D18 -125.89 5.62 -8.51 -0.31 0
371309 127345660 1 Cl2N2O3C17H20 A2B2C3D17E20 -137.53 1.9 -9.5 -0.68 0
371310 127345661 1 Cl2N2O3C18H22 A2B2C3D18E22 -140.58 8.26 -8.87 -0.43 0
371311 127345662 1 SO2N4C18H22 AB2C4D18E22 -9.24 3.51 -8.93 -1.12 0
371312 127345663 1 N2O3C17H24 A2B3C17D24 -117.15 2.96 -8.32 0.01 0
371313 127345676 1 N2O3C12H20 A2B3C12D20 -149.69 8.59 -9.62 0.64 0
371314 127345677 1 Cl2N2O3C18H22 A2B2C3D18E22 -142.14 4.66 -8.89 -0.48 0
371315 127345678 1 O2N3C12H19 A2B3C12D19 -60.35 4.68 -9.5 0.3 0
371316 127345679 1 N2O3C13H18 A2B3C13D18 -110.83 5.49 -8.8 -0.33 0