List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
52410 12015269 1 NO4C18H21 AB4C18D21 -132.91 4.31 -8.47 -0.41 0
52411 12015270 1 NO3C18H23 AB3C18D23 -114.54 5.06 -8.26 0.1 0
52412 12015271 1 ClSN2O3H9C12 ABC2D3E9F12 -67.73 5.88 -10.26 -1.14 0
52413 12015272 1 SN3H11C14 AB3C11D14 104.8 7.13 -8.54 -1.33 0
52414 12015273 1 BrS2N3H10C12 AB2C3D10E12 116.91 3.37 -9.21 -2.09 0
52415 12015274 1 BrOSN3H10C15 ABCD3E10F15 71.78 3.42 -9.36 -1.84 0
52416 12015275 1 OSN4H16C21 ABC4D16E21 94.99 2.27 -8.38 -1.8 0
52417 12015277 1 BrSN4H13C18 ABC4D13E18 139.49 4.37 -8.79 -1.7 0
52418 12015278 1 BrOS2N3H10C16 ABC2D3E10F16 95.83 4.56 -9.1 -2.06 0
52419 12015279 1 BrOSN2H11C15 ABCD2E11F15 40.86 3.54 -9.16 -1.36 0
52420 12015280 1 OSN3H17C21 ABC3D17E21 64.36 0.76 -8.27 -1.13 0
52421 12015281 1 BrClOSN2H14C22 ABCDE2F14G22 75.68 4.01 -9.15 -1.81 0
52422 12015282 1 ClOSN3H20C28 ABCD3E20F28 100.27 2.56 -8.29 -1.62 0
52423 12015283 1 OSN3H23C29 ABC3D23E29 99.49 1.92 -8.2 -1.43 0
52424 12015285 1 BrOSN3H16C18 ABCD3E16F18 58.73 9.68 -8.27 -1.16 0
52425 12015286 1 BrSO2N4H19C26 ABC2D4E19F26 70.6 3.73 -8.55 -0.8 0
52426 12015287 1 OSN5H23C31 ABC5D23E31 135.25 4.63 -8.22 -0.72 0
52427 12015288 1 SO2N5H25C32 AB2C5D25E32 93.97 2.8 -8.11 -0.63 0
52428 12015289 1 BrSN2O2H11C17 ABC2D2E11F17 16.35 2.69 -8.69 -1.3 0
52429 12015290 1 BrON3H18C22 ABC3D18E22 57.17 6.28 -8.88 -0.49 0
52430 12015291 1 ClON4H21C27 ABC4D21E27 81.44 1.42 -8.12 -0.6 0
52431 12015292 1 BrO2N3H14C22 AB2C3D14E22 33.27 5.12 -8.52 -1.03 0
52432 12015294 1 BrOS2N3H8C16 ABC2D3E8F16 94.46 3.43 -9.28 -2.51 0
52433 12015296 1 NPO4C16H16 ABC4D16E16 -151.29 2.81 -9.04 -0.94 0
52434 12015297 1 NPO4C20H24 ABC4D20E24 -175.11 0.6 -8.89 -0.82 0
52435 12015298 2 NOH12C18 ABC12D18 128.19 2.25 -8.78 -1.2 0
52436 12015299 2 NO2H14C19 AB2C14D19 52.74 3.11 -8.44 -1.15 0
52437 12015300 2 NO2H16C20 AB2C16D20 38.08 4.76 -8.53 -1.15 0
52438 12015301 2 NO2H20C22 AB2C20D22 19.62 3.04 -8.73 -1.03 0
52439 12015302 2 NOH20C22 ABC20D22 80.49 0.92 -8.76 -1.05 0
52440 12015303 2 NO2H22C23 AB2C22D23 2.98 0.31 -8.24 -1.15 0
52441 12015304 2 NO2C24H24 AB2C24D24 -11.15 1.75 -8.2 -1.09 0
52442 12015305 2 NO2C26H28 AB2C26D28 -30.19 2.27 -8.21 -1.04 0
52443 12015306 2 NC7H12 AB7C12 -10.47 1.45 -8.72 0.51 0
52444 12015307 1 O4N6C41H48 A4B6C41D48 -35.47 3.11 -8.51 0.17 0
52445 12015308 1 O4N6C41H64 A4B6C41D64 -156.79 1.04 -8.86 -0.03 0
52446 12015309 1 O4N6C45H72 A4B6C45D72 -159.31 1.04 -8.49 0.2 0
52447 12015310 1 O5N6C35H60 A5B6C35D60 -196.41 2.28 -8.87 0.17 0
52448 12015311 1 S2N6O8C39H64 A2B6C8D39E64 -329.23 5.1 -8.99 -1.17 0
52449 12015312 1 N6O6C39H64 A6B6C39D64 -301.38 5.62 -9.24 0.1 0
52450 12015313 2 OC4H7 AB4C7 -101.71 2.79 -9.82 0.91 0
52451 12015314 1 O2C9H14 A2B9C14 -104.88 2.49 -9.26 0.94 0
52452 12015316 1 NSO3C12H17 ABC3D12E17 -116.8 3.39 -10.18 0.01 0
52453 12015317 1 NSO3C12H15 ABC3D12E15 -83.62 3.34 -10.1 -0.02 0
52454 12015318 1 NSO3C13H17 ABC3D13E17 -86.55 4.16 -10.2 -0.1 0
52455 12015320 1 NSO3C17H23 ABC3D17E23 -102.92 4.28 -9.62 0.0 0
52456 12015321 1 NSO3C17H21 ABC3D17E21 -70.92 4.46 -9.59 -0.02 0
52457 12015322 1 NSO3C18H23 ABC3D18E23 -74.32 4.87 -9.55 -0.12 0
52458 12015323 1 ON3H13C18 AB3C13D18 146.76 6.61 -9.67 -0.41 0
52459 12015324 1 ON3H15C19 AB3C15D19 92.47 2.04 -9.9 -0.54 0
52460 12015325 1 ON3H17C20 AB3C17D20 107.81 3.09 -9.27 -1.21 0
52461 12015326 1 O2N3H15C19 A2B3C15D19 119.39 15.0 -7.05 -2.5 0
52462 12015327 2 ON2H6C7 AB2C6D7 79.28 1.12 -9.56 -1.78 0
52463 12015328 1 O2N3H15C19 A2B3C15D19 74.11 3.92 -9.86 -0.52 0
52468 12015335 1 SN2C7H14 AB2C7D14 20.83 4.66 -9.06 -0.35 0
52469 12015336 1 SN2O2C12H14 AB2C2D12E14 -34.91 4.91 -9.58 -0.55 0
52470 12015337 1 NSO5C17H21 ABC5D17E21 -162.77 9.04 -9.15 -0.34 0
52471 12015338 1 NSC8H15 ABC8D15 -0.15 4.12 -9.35 -0.26 0
52472 12015344 1 NO4C13H23 AB4C13D23 -220.02 2.92 -9.61 0.3 0
52473 12015346 1 NO2C14H23 AB2C14D23 -130.2 3.61 -10.12 0.21 0
52474 12015349 1 FeOH16C18 ABC16D18 47.54 3.24 -8.86 -0.99 0
52475 12015351 1 FeO2C18H18 AB2C18D18 50.18 3.4 -8.4 -0.56 0
52476 12015353 1 FeNOC18H19 ABCD18E19 44.49 5.12 -8.59 -0.33 0
52477 12015354 1 NOC13H15 ABC13D15 11.65 2.16 -9.35 -0.03 0
52478 12015355 1 FeNO2H17C19 ABC2D17E19 37.52 16.0 -6.65 -1.98 0
52479 12015356 1 NO2H13C14 AB2C13D14 -21.19 5.54 -9.84 -0.23 0
52480 12015357 1 FeNaSN2O2H17C18 ABCD2E2F17G18 50.31 10.49 -6.67 -0.93 0
52481 12015358 1 SN2O2C13H14 AB2C2D13E14 4.14 5.54 -9.37 -0.49 0
52482 12015359 1 SO2C19H20 AB2C19D20 -20.86 1.21 -9.3 -0.41 0
52483 12015361 1 NO2C21H21 AB2C21D21 -32.88 2.99 -8.47 -0.39 0
52484 12015362 1 NO3C22H23 AB3C22D23 -71.07 3.64 -8.72 -0.39 0
52485 12015363 1 O2F3H5C7 A2B3C5D7 -158.5 8.6 -9.85 -0.85 0
52486 12015364 2 OC4H5 AB4C5 -16.97 6.39 -9.33 -0.06 0
52487 12015365 2 OC5H7 AB5C7 -27.99 6.85 -9.3 -0.19 0
52488 12015366 1 N2C7H10 A2B7C10 14.25 3.49 -9.05 0.18 0