List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
339379 127261275 1 ClNO2C9H10 ABC2D9E10 -33.5 2.49 -8.81 -0.29 0
339380 127261276 1 ClNO2C8H8 ABC2D8E8 -23.14 3.67 -8.9 -0.4 0
339381 127261277 1 N2O2C11H12 A2B2C11D12 12.6 1.39 -7.85 -0.09 0
339382 127261278 1 NO5C12H13 AB5C12D13 -96.55 5.34 -8.23 -0.28 0
339383 127261279 1 ON3H11C12 AB3C11D12 74.63 3.18 -9.64 -0.76 0
339384 127261280 1 N2O5H10C11 A2B5C10D11 -16.14 7.86 -8.66 -1.52 0
339385 127261281 1 NSO2C11H11 ABC2D11E11 4.12 0.92 -8.29 -0.21 0
339386 127261282 1 NO2C20H33 AB2C20D33 -76.29 2.27 -8.76 -0.02 0
339387 127261283 1 OC15H24 AB15C24 -57.39 3.23 -8.96 0.98 0
339388 127261284 1 O2F3H11C15 A2B3C11D15 -193.61 4.53 -9.52 -0.82 0
339389 127261285 1 NOF4H13C16 ABC4D13E16 -152.6 3.19 -9.11 -0.26 0
339390 127261286 1 OC18H18 AB18C18 77.14 4.08 -9.14 -0.68 0
339391 127261287 1 OSN3C10H17 ABC3D10E17 15.27 1.75 -8.46 -0.31 0
339392 127261288 1 OSN3C12H21 ABC3D12E21 8.14 2.11 -8.01 -0.07 0
339393 127261289 1 SO2N3C8H13 AB2C3D8E13 -14.56 2.4 -8.62 -0.48 0
339394 127261290 1 BrOSN3C12H12 ABCD3E12F12 63.07 3.99 -8.51 -0.82 0
339395 127261291 1 ClOSN3C12H12 ABCD3E12F12 52.09 5.25 -8.22 -0.57 0
339396 127261292 1 SO2N3C14H17 AB2C3D14E17 15.46 2.17 -8.1 -0.46 0
339397 127261293 1 NO2H13C15 AB2C13D15 -16.56 5.84 -8.42 -1.23 0
339398 127261294 1 NO3C17H27 AB3C17D27 -94.07 2.6 -8.46 0.09 0
339399 127261295 1 NO3C13H19 AB3C13D19 -74.3 1.56 -8.31 0.14 0
339400 127261296 1 NO2C16H25 AB2C16D25 -54.68 2.63 -8.7 -0.04 0
339401 127261297 1 NO2C17H19 AB2C17D19 -3.79 2.96 -8.74 -0.09 0
339402 127261298 1 NO2C12H17 AB2C12D17 -37.32 2.57 -8.66 -0.03 0
339403 127261299 1 O3H14C16 A3B14C16 -81.1 3.06 -9.36 -0.53 0
339404 127261300 2 O2C10H11 A2B10C11 -105.2 3.31 -8.76 -0.17 0
339405 127261301 1 NO2C16H25 AB2C16D25 -62.32 2.27 -8.14 0.33 0
339406 127261302 1 NO3H21C22 AB3C21D22 -3.65 1.74 -8.81 -0.04 0
339407 127261303 1 NO4C13H17 AB4C13D17 -69.35 4.92 -8.4 0.17 0
339408 127261304 1 NO4C17H19 AB4C17D19 -59.33 5.21 -8.43 0.13 0
339409 127261305 1 OC15H24 AB15C24 -64.56 3.31 -9.19 0.74 0
339410 127261306 1 SO3C11H12 AB3C11D12 -88.17 6.96 -10.07 -1.17 0
339411 127261307 1 INOPH25C27 ABCDE25F27 35.6 3.9 -8.14 -0.57 0
339412 127261308 1 OH16C17 AB16C17 8.59 4.42 -8.9 -0.56 0
339413 127261309 1 OC14H22 AB14C22 -61.47 2.93 -9.13 0.74 0
339414 127261310 1 N3O3C13H19 A3B3C13D19 -12.17 6.03 -8.57 -1.08 0
339415 127261311 1 NOC16H17 ABC16D17 5.22 3.05 -8.28 -0.11 0
339416 127261312 1 OC15H24 AB15C24 -66.64 3.22 -8.99 0.76 0
339417 127261313 1 NOC12H17 ABC12D17 3.46 1.07 -8.57 0.39 0
339418 127261314 1 NOC14H17 ABC14D17 21.82 1.36 -8.57 0.26 0
339419 127261315 1 NO2C13H19 AB2C13D19 -44.58 3.12 -8.75 0.2 0
339420 127261316 1 NOC11H15 ABC11D15 8.5 1.16 -8.59 0.36 0
339421 127261317 1 NO2C19H29 AB2C19D29 -36.19 1.9 -8.26 0.17 0
339422 127261318 1 NO2C10H13 AB2C10D13 -27.72 3.46 -8.8 0.13 0
339423 127261319 1 NO3C20H33 AB3C20D33 -108.8 2.4 -8.32 0.11 0
339424 127261320 1 SO3C11H12 AB3C11D12 -87.72 4.8 -10.13 -1.36 0
339425 127261321 1 SO2H14C16 AB2C14D16 1.59 2.97 -8.52 -0.84 0
339426 127261322 1 ON2C20H24 AB2C20D24 -23.78 3.72 -8.32 0.16 0
339427 127261323 1 O3C20H30 A3B20C30 -135.03 7.22 -9.11 -0.29 0
339428 127261324 1 NO3C15H21 AB3C15D21 -79.38 2.41 -8.78 0.21 0