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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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25446 625191 1 NO3C17H19 AB3C17D19 -86.01 4.84 -8.52 -0.23 0
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25447 625192 2 O3H6C8 A3B6C8 -155.84 4.72 -8.27 -1.68 0
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25448 625193 1 OB2S2C25H36 AB2C2D25E36 189.08 7.85 -7.29 -1.66 0
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25449 625194 1 O2N3S3H7C9 A2B3C3D7E9 86.45 6.27 -9.04 -1.7 0
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25450 625215 1 Cl2N2O3H16C17 A2B2C3D16E17 -24.27 2.99 -9.47 -0.92 0
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25451 625219 1 ClON3H12C15 ABC3D12E15 45.64 2.59 -9.4 -0.86 0
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25452 625244 1 NOC19H27 ABC19D27 65.0 0.56 -8.2 0.6 0
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25453 625277 1 ClO3H11C16 AB3C11D16 -49.35 3.42 -9.28 -1.27 0
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25454 625312 1 O4C21H30 A4B21C30 -205.61 3.89 -9.69 0.02 0
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25455 625318 1 NC27H39 AB27C39 -22.26 1.56 -8.85 0.4 0
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25456 625325 1 O3C19H28 A3B19C28 -172.17 2.88 -9.85 0.58 0
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25457 625329 1 N2O3C16H18 A2B3C16D18 -48.91 2.06 -8.54 -0.67 0
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25458 625376 1 OH18C21 AB18C21 45.31 1.55 -8.66 0.24 0
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25459 625388 1 NOC26H27 ABC26D27 13.34 0.96 -8.49 0.2 0
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25460 625389 1 O2H20C21 A2B20C21 -21.99 2.57 -9.32 0.01 0
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25461 625390 1 OSN2C16H18 ABC2D16E18 -6.87 6.1 -9.08 -0.65 0
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25462 625391 1 S3H10C15 A3B10C15 101.52 4.3 -8.6 -1.33 0
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25463 625392 1 SiO3C16H18 AB3C16D18 -170.98 3.65 -8.29 -0.03 0
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25464 625393 2 O2C10H13 A2B10C13 -182.4 5.13 -8.76 -0.5 0
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25465 625394 1 O3C20H28 A3B20C28 -146.38 2.67 -8.67 0.1 0
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25466 625395 1 OSN2C16H18 ABC2D16E18 53.7 5.89 -8.97 -1.39 0
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25467 625396 1 SN4C15H18 AB4C15D18 110.39 11.9 -8.24 -1.07 0
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25468 625397 1 NO3C22H29 AB3C22D29 -99.59 8.57 -8.38 -0.28 0
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25469 625398 1 SN2O2H14C15 AB2C2D14E15 57.44 6.65 -8.89 -1.35 0
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25470 625406 1 IN2C10H11 AB2C10D11 58.83 2.35 -9.12 -0.87 0
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25471 625407 1 IN2C10H11 AB2C10D11 61.56 1.69 -9.02 -0.77 0
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25472 625420 1 O3C19H28 A3B19C28 -169.75 5.16 -9.58 0.9 0
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25473 625454 2 ClNH2O2C5 ABC2D2E5 -14.5 4.36 -10.3 -2.53 -4
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25474 625457 1 BC11H11 AB11C11 93.19 1.34 -8.43 -0.56 0
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25475 625460 1 NOSiH15C19 ABCD15E19 27.08 5.84 -9.64 -1.0 0
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25476 625580 1 ClFON2H16C18 ABCD2E16F18 -35.25 3.02 -9.16 -0.88 0
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25477 625581 2 O3C9H10 A3B9C10 -188.33 8.27 -8.33 -0.18 0
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25478 625587 1 ON2H20C25 AB2C20D25 88.94 2.02 -9.05 -0.82 0
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25479 625588 4 OC6H9 AB6C9 -229.2 7.26 -9.78 0.34 -6
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25480 625640 1 SiC10H16 AB10C16 1.01 1.25 -8.59 0.56 0
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25481 625642 1 ClINO2C17H17 ABCD2E17F17 -47.17 6.87 -8.62 -0.88 0
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25482 625645 1 NO9C14H21 AB9C14D21 -359.35 3.39 -9.1 0.04 0
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25483 625668 1 SH16C20 AB16C20 124.44 0.82 -8.62 -0.79 0
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25484 625671 1 Si2Cl4H6C7 A2B4C6D7 -157.65 0.7 -9.74 -0.64 0
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25485 625672 1 Br2N2C11H12 A2B2C11D12 40.4 2.46 -8.75 -0.6 0
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25486 625681 1 ClS2H9C15 AB2C9D15 76.34 2.95 -8.65 -1.81 0
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25487 625687 1 ClN5C14H16 AB5C14D16 48.4 1.85 -8.73 -0.18 0
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25488 625690 1 NO2F3H12C16 AB2C3D12E16 -187.4 6.41 -9.46 -1.08 0
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25489 625692 1 ClNH12C19 ABC12D19 89.5 3.17 -8.74 -1.42 0
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25490 625752 1 N2O7C18H36 A2B7C18D36 -299.49 4.79 -8.71 1.55 0
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25491 625837 1 N2O2Si3C21H38 A2B2C3D21E38 -220.21 1.35 -7.99 0.1 0
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25492 625848 1 ON2H18C19 AB2C18D19 37.66 0.81 -8.6 -1.03 0
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25493 625861 1 SN2O2C15H18 AB2C2D15E18 -31.36 2.26 -8.34 -0.87 0
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25494 625872 1 N2S2C15H18 A2B2C15D18 51.83 7.16 -7.89 -0.94 0
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25495 625873 1 ClNO4C18H20 ABC4D18E20 -152.41 4.67 -8.88 -0.62 0