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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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53482 14716308 1 ClO4C32H37 AB4C32D37 -145.23 8.49 -9.02 -1.07 0
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53483 14716309 1 O4C33H40 A4B33C40 -146.88 7.38 -8.97 -0.93 0
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53484 14716314 1 O5C36H46 A5B36C46 -204.76 8.82 -9.01 -1.1 0
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53485 14716319 2 O2C18H19 A2B18C19 -97.62 6.98 -8.94 -0.92 0
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53486 14716341 1 ON2H8C13 AB2C8D13 97.78 2.64 -9.62 -2.79 0
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53487 14716342 1 Cl2O5N6H28C47 A2B5C6D28E47 55.5 5.4 -8.74 -2.14 0
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53489 14716352 1 NaSO7C24H41 ABC7D24E41 -375.8 10.17 -8.77 0.14 0
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53490 14716356 1 NaSO6C20H33 ABC6D20E33 -339.39 8.37 -9.38 -0.16 0
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53491 14716357 1 SO6C20H34 AB6C20D34 -273.43 3.08 -9.01 -1.15 0
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53492 14716362 1 N3C44H79 A3B44C79 -80.9 4.69 -9.0 -0.83 0
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53494 14716367 1 ClSN3O3C11H14 ABC3D3E11F14 -87.06 3.65 -9.33 -1.27 0
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53495 14716368 1 N3C15H17 A3B15C17 95.37 4.52 -9.04 -0.77 0
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53496 14716369 1 SN3O3C22H25 AB3C3D22E25 2.65 7.99 -8.99 -0.78 0
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53497 14716373 1 NSO4C7H13 ABC4D7E13 -183.26 4.37 -9.45 -0.06 0
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53498 14716374 1 SN2O3C8H16 AB2C3D8E16 -141.47 4.71 -9.12 0.0 0
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53499 14716375 1 SN2O4C6H10 AB2C4D6E10 -181.2 6.77 -9.45 -0.07 0
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53500 14716379 1 SN2O3C10H12 AB2C3D10E12 -108.32 2.89 -8.97 -0.16 0
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53501 14716380 1 NSF3O3H10C11 ABC3D3E10F11 -265.68 2.9 -9.77 -1.38 0
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53502 14716381 1 NSO4C11H13 ABC4D11E13 -157.43 4.7 -9.49 -0.48 0
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53503 14716385 1 ClN3O3C35H38 AB3C3D35E38 -22.22 5.46 -7.88 -0.66 0
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53504 14716386 1 O2N3C34H37 A2B3C34D37 15.1 5.12 -8.03 -0.29 0
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53505 14716387 1 ClO2N3C33H34 AB2C3D33E34 18.05 2.51 -8.1 -0.65 0
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53506 14716391 2 NO2H16C17 AB2C16D17 -69.18 5.61 -8.39 -0.7 0
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53507 14716392 1 N2O5H32C34 A2B5C32D34 -107.2 10.85 -8.46 -0.78 0
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53508 14716393 1 ClSN2O4H7C11 ABC2D4E7F11 -62.64 4.86 -9.32 -1.87 0
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53509 14716395 1 S3N6O16H28C46 A3B6C16D28E46 -184.74 2.99 -9.04 -1.8 3
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53510 14716408 1 Br3S3N6O13H22C43 A3B3C6D13E22F43 -169.91 9.08 0.0 0.0 0
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53511 14716409 1 S6N9O19H37C49 A6B9C19D37E49 -329.42 6.65 -8.96 -1.97 1
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53512 14716412 1 SN2O4C9H13 AB2C4D9E13 -143.38 5.63 0.0 0.0 0
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53513 14716420 1 O2H3N3C10 A2B3C3D10 38.36 3.67 -10.29 -2.46 0
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53514 14716422 1 BrC13H15 AB13C15 54.55 1.9 -9.06 -0.26 0
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53515 14716424 1 FC27H29 AB27C29 -2.17 2.25 -9.02 -0.04 0
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53516 14716425 1 FC27H27 AB27C27 34.24 2.55 -8.85 -0.3 0
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53517 14716428 2 SO4C11H13 AB4C11D13 -263.25 6.99 -9.36 -0.97 0
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53518 14716429 1 N3O5C42H51 A3B5C42D51 -145.4 4.03 -8.32 -1.02 0
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53519 14716430 1 N4O8C35H42 A4B8C35D42 -196.05 9.62 -9.47 -1.62 0
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53520 14716432 1 N2O5C13H22 A2B5C13D22 -210.55 4.64 -8.82 -0.46 0
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53521 14716433 1 SiCl3C18H25 AB3C18D25 -96.38 1.78 -9.89 -0.68 0
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53522 14716437 1 ClON3C20H26 ABC3D20E26 -2.05 2.55 -8.44 -0.46 0
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53523 14716438 1 ClON3C17H20 ABC3D17E20 12.8 2.58 -8.45 -0.47 0
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53524 14716439 1 NOS2C8H11 ABC2D8E11 -27.35 4.31 -9.19 -0.96 0
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53525 14716440 1 NOS2C9H13 ABC2D9E13 -34.53 1.71 -9.08 -0.99 0
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53526 14716441 1 NOS2C6H9 ABC2D6E9 -27.99 1.56 -9.12 -1.04 0
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53527 14716445 1 SN3C9H17 AB3C9D17 8.95 5.02 -8.56 -0.16 0
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53528 14716451 1 N3O3C17H17 A3B3C17D17 -52.64 5.6 -8.5 -0.62 0
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53529 14716471 1 O2N4C23H26 A2B4C23D26 58.13 11.63 -8.07 -1.52 0
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53530 14716472 1 O3N4C23H26 A3B4C23D26 27.88 14.2 -8.14 -1.41 2
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53531 14716478 2 N2O3C9H12 A2B3C9D12 -96.42 3.63 -9.84 -1.27 0
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53532 14716493 2 N4H33C34 A4B33C34 269.18 6.91 -7.54 -2.04 0
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53533 14716497 2 NC12H15 AB12C15 38.9 7.08 -9.32 -1.5 0