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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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3392 9606 1 FC7H7 AB7C7 -34.92 2.18 -9.56 0.09 0
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3393 9607 1 FO3C14H25 AB3C14D25 -228.64 4.88 -10.47 0.31 0
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3394 9608 1 O2F3C6H7 A2B3C6D7 -238.31 3.12 -10.96 -0.56 0
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3395 9609 1 SC4H10 AB4C10 -19.15 2.15 -8.5 0.89 0
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3396 9610 1 N2O4C7H10 A2B4C7D10 -133.7 3.29 -9.62 -1.48 0
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3397 9611 1 FO2C12H23 AB2C12D23 -189.02 2.81 -10.81 0.86 0
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3398 9612 1 FC7H11 AB7C11 -19.25 1.56 -10.68 1.75 0
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3399 9613 1 FNOC5H8 ABCD5E8 -83.31 1.63 -10.46 0.28 0
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3400 9614 1 FNC7H16 ABC7D16 -78.87 2.83 -9.42 3.08 0
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3401 9615 1 FOC7H15 ABC7D15 -116.32 2.6 -9.68 2.22 0
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3402 9616 1 FO2C8H15 AB2C8D15 -168.22 3.64 -11.11 0.57 0
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3403 9617 1 BrFC12H24 ABC12D24 -105.24 3.58 -10.38 0.05 0
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3404 9618 2 FC6H12 AB6C12 -155.21 2.62 -10.9 3.11 0
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3405 9619 1 FOC12H25 ABC12D25 -145.1 2.57 -10.16 2.79 0
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3406 9620 1 FC2H5 AB2C5 -61.94 1.82 -12.17 3.25 0
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3407 9621 1 BOC2F3H6 ABC2D3E6 -316.0 1.8 -9.8 0.81 0
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3408 9622 1 CClFO ABCD -95.18 1.09 -12.29 -1.08 0
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3409 9624 1 BrCFCl2 ABCD2 -51.09 0.42 -11.4 -2.06 0
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3410 9625 1 BrCClF2 ABCD2 -100.62 0.63 -11.49 -2.14 0
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3411 9626 1 FC4H9 AB4C9 -81.18 2.08 -11.95 3.43 0
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3412 9627 1 SiC2F2H6 AB2C2D6 -216.76 2.53 -10.56 1.06 0
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3413 9628 1 BrClHC2F3 ABCD2E3 -155.38 1.67 -11.51 -1.82 0
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3414 9629 1 FOC2Cl3 ABC2D3 -103.34 1.32 -11.59 -1.46 0
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3415 9631 1 HC2Cl2F3 AB2C2D3 -175.32 1.57 -11.57 -1.0 0
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3416 9632 1 ClHC2F4 ABC2D4 -216.38 1.63 -11.98 -0.84 0
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3417 9633 1 HC2F5 AB2C5 -261.48 1.77 -13.81 0.52 0
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3418 9634 1 ClBr2C2F3 AB2C2D3 -138.77 0.31 -11.4 -2.33 0
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3419 9635 1 C2Cl3F3 A2B3C3 -180.45 0.87 -11.65 -1.11 0
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3420 9636 1 IC2F5 AB2C5 -239.46 1.39 -11.02 -2.71 0
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3421 9638 2 C2F5 A2B5 -508.7 0.41 -13.98 -0.6 0
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3422 9639 2 C3F7 A3B7 -702.29 0.43 -13.8 -0.75 0
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3423 9640 6 CF2 AB2 -588.39 0.0 -13.64 -0.6 0
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3424 9641 1 OH4C5F8 AB4C5D8 -448.93 2.29 -11.51 0.2 0
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3425 9642 1 F2O7C26H32 A2B7C26D32 -400.89 7.51 -10.09 -0.77 0
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3426 9644 1 O2H5C6F7 A2B5C6D7 -441.82 3.35 -11.78 -0.55 0
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3428 9647 1 FO3C19H25 AB3C19D25 -143.96 3.54 -8.83 -0.38 0
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3429 9648 1 N2O2C25H32 A2B2C25D32 -44.59 6.05 -8.26 0.07 0
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3430 9649 1 N2O4C23H26 A2B4C23D26 -110.36 4.68 -7.95 0.13 0
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3431 9650 1 N2O3C14H16 A2B3C14D16 -115.98 1.78 -9.72 -0.56 0
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3432 9651 1 NO3C17H21 AB3C17D21 -81.72 3.63 -8.2 0.21 0
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3433 9652 1 INOSC16H22 ABCDE16F22 7.29 15.79 -7.14 -0.97 0
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3434 9653 1 NOSC16H22 ABCD16E22 27.85 1.61 0.0 0.0 1
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3435 9654 1 ClINOC16H25 ABCDE16F25 -59.78 9.87 -7.53 -0.64 0
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3436 9655 1 ClNOC16H25 ABCD16E25 -26.67 2.15 0.0 0.0 1
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3437 9656 1 INO2C16H26 ABC2D16E26 -62.75 10.19 -7.24 -0.12 0
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3438 9657 1 NO2C16H26 AB2C16D26 -38.15 3.09 0.0 0.0 1
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3439 9658 1 OC4F10 AB4C10 -562.3 0.36 -13.38 -1.46 0
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3440 9659 1 OF4C6H10 AB4C6D10 -270.36 4.28 -11.23 0.52 0
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3441 9660 1 FSiC6H15 ABC6D15 -139.85 2.09 -9.56 1.11 0
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3442 9661 1 NO2C10H15 AB2C10D15 -65.26 2.3 -10.5 0.84 0