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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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386438 134981753 1 O4C17H18 A4B17C18 -121.6 3.29 -9.05 -0.23 0
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386439 134981754 1 F3O3H15C17 A3B3C15D17 -243.63 3.8 -9.65 -1.02 0
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386440 134981756 1 S2O3H16C17 A2B3C16D17 -26.37 3.81 -8.55 -0.55 0
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386441 134981758 1 OC20H25 AB20C25 -2.86 1.66 0.0 0.0 0
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386442 134981759 1 NO4C18H21 AB4C18D21 -73.01 6.46 -9.2 -1.32 1
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386443 134981761 1 PSiO3C39H52 ABC3D39E52 -15.53 3.02 0.0 0.0 0
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386444 134981765 1 OC10H20 AB10C20 -81.82 1.57 -9.25 1.28 0
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386446 134981774 4 OC6H7 AB6C7 -135.24 1.3 -9.01 -0.19 0
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386447 134981778 1 NC17H21 AB17C21 103.96 2.25 -7.96 -0.09 0
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386448 134981782 2 O2H14C15 A2B14C15 -43.53 2.27 -8.37 -0.05 0
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386449 134981783 2 O2H14C15 A2B14C15 -51.99 5.71 -8.34 0.41 0
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386450 134981785 1 C19H36 A19B36 -67.02 0.13 -8.68 1.64 0
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386451 134981786 1 IPH20C21 ABC20D21 69.56 6.73 -7.84 -0.22 0
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386452 134981792 1 NOC17H29 ABC17D29 -82.32 4.26 -9.15 1.52 0
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386453 134981794 1 SiO6C45H54 AB6C45D54 -199.24 4.0 -8.88 0.08 0
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386454 134981804 1 SSiO6C33H48 ABC6D33E48 -287.7 6.93 -8.62 -0.67 0
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386455 134981807 1 SSiO3C28H38 ABC3D28E38 -154.29 2.83 -9.0 0.12 0
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386456 134981810 1 NSSiO3C28H33 ABCD3E28F33 -82.38 6.84 -8.81 -0.56 0
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386457 134981812 2 OC7H10 AB7C10 -93.72 0.88 -9.39 0.29 0
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386458 134981815 1 Si3O5C55H88 A3B5C55D88 -353.15 3.32 -8.72 0.0 0
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386459 134981816 1 NO4C29H35 AB4C29D35 -102.77 3.99 -8.84 0.05 0
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386460 134981819 1 SiO3C27H30 AB3C27D30 -86.81 1.55 -8.69 -0.12 0
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386461 134981820 1 O2C13H22 A2B13C22 -94.65 1.34 -9.6 0.88 0
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386462 134981823 1 ClOSeC14H17 ABCD14E17 -4.79 5.06 -8.38 -0.52 0
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386463 134981829 1 OSiC13H22 ABC13D22 -81.68 0.78 -8.25 0.63 0
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386464 134981831 1 O2C21H30 A2B21C30 -63.33 2.71 -8.8 0.59 0
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386466 134981835 1 OC12H16 AB12C16 -36.13 1.78 -9.17 0.42 0
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386467 134981849 2 O2C10H11 A2B10C11 -104.88 3.71 -8.8 -0.78 0
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386469 134981856 12 H2C3 A2B3 148.89 0.03 -8.81 -0.4 0
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386470 134981857 1 NOH21C27 ABC21D27 76.4 2.55 -8.0 -0.39 0
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386471 134981860 1 NSiI2O2C20H29 ABC2D2E20F29 -54.18 5.6 -9.27 -0.82 0
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386472 134981862 2 O7C19H23 A7B19C23 -509.59 15.22 -9.49 -3.09 0
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386473 134981866 1 NC6H7 AB6C7 49.95 3.75 -9.74 -0.63 0
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386474 134981870 1 N2O5C19H20 A2B5C19D20 -102.96 2.94 -9.18 -0.56 0
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386475 134981871 1 SiN2O2C17H32 AB2C2D17E32 -125.08 7.24 -9.34 -0.16 0
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386479 134981887 1 SiO4C16H26 AB4C16D26 -199.02 1.25 -9.29 0.41 0
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386480 134981890 2 O2C7H10 A2B7C10 -181.84 4.57 -10.36 -0.38 0
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386481 134981891 1 ISi2O6C33H59 AB2C6D33E59 -376.43 2.1 -8.81 -0.95 0
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386482 134981892 1 O3C19H20 A3B19C20 -49.69 3.51 -8.13 -0.08 0
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386483 134981896 1 INO3C18H30 ABC3D18E30 -149.02 2.86 -9.17 -0.7 0
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386484 134981897 1 OC15H20 AB15C20 -28.59 3.28 -8.94 0.04 0
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386485 134981899 1 Si2O6C51H62 A2B6C51D62 -225.17 5.91 -9.01 -0.36 0
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386486 134981902 1 SCl3N3O6C37H54 AB3C3D6E37F54 -270.73 3.23 -8.73 -0.6 0
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386487 134981904 1 NC18H23 AB18C23 94.28 3.28 -7.86 0.03 0
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386488 134981915 1 NSSiO4C23H39 ABCD4E23F39 -210.02 6.31 -8.73 -0.29 0
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386489 134981918 2 OC7H10 AB7C10 -93.75 0.98 -9.34 0.34 0
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386490 134981919 3 O2C13H14 A2B13C14 -114.65 3.36 -8.87 -0.07 0
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386491 134981920 2 OC10H15 AB10C15 -106.44 2.73 -9.46 0.28 0
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386492 134981923 2 SiO2C16H29 AB2C16D29 -340.48 1.6 -8.65 0.41 0
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386493 134981925 1 FeO5C12H14 AB5C12D14 -77.04 1.38 -8.52 0.02 0
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386494 134981926 1 O2C9H14 A2B9C14 -78.13 1.63 -9.53 -0.01 0
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386495 134981929 1 NSH23C25 ABC23D25 90.67 3.39 -7.9 0.09 0
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386496 134981931 1 O3C13H20 A3B13C20 -124.81 5.1 -10.08 0.57 0
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386497 134981932 1 NC10H17 AB10C17 17.41 1.31 -8.59 1.22 0
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386498 134981934 1 OCl3C6H7 AB3C6D7 -39.17 2.7 -10.16 -0.41 0
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386499 134981938 2 OC11H20 AB11C20 -147.59 1.77 -8.6 0.6 0
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386500 134981941 1 O5C15H16 A5B15C16 -179.96 2.94 -9.74 -1.33 0
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386501 134981948 4 OC5H7 AB5C7 -125.71 4.35 -9.5 -1.05 0
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386502 134981954 2 O2H10C11 A2B10C11 -87.37 1.5 -8.04 -0.8 0
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386503 134981955 1 O3C14H16 A3B14C16 -104.96 2.94 -9.54 -0.89 0
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386504 134981967 1 BrSiC25H31 ABC25D31 71.32 2.51 -8.49 -0.71 0
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386505 134981969 1 ClFH10C22 ABC10D22 27.68 2.16 -8.38 -1.45 0
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386506 134981978 4 OC6H9 AB6C9 -176.1 3.66 -8.51 0.07 0
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386507 134981979 2 O2C5H7 A2B5C7 -151.92 3.79 -10.22 -0.89 0
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386508 134981980 1 N2O4C19H32 A2B4C19D32 -191.75 9.35 -9.57 -0.83 0
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386510 134981984 1 F3C10H13 A3B10C13 -159.7 3.01 -9.78 0.0 0
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386511 134981991 1 OF3C15H17 AB3C15D17 -179.26 4.39 -9.73 -0.57 0
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386512 134981992 1 CoB2C32H51 AB2C32D51 -54.37 33.68 -9.75 -5.85 0
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386513 134981996 1 NSO4C23H23 ABC4D23E23 -99.29 4.9 -9.27 -0.52 0
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386514 134982000 1 NSO2C17H23 ABC2D17E23 -37.13 5.7 -8.37 0.06 0
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386515 134982012 1 BrOC21H41 ABC21D41 -124.12 0.6 -9.57 -0.05 0
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386516 134982013 1 PSO2C23H25 ABC2D23E25 -40.97 6.93 -8.1 -0.15 0
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386517 134982014 1 NaO6C31H49 AB6C31D49 -360.28 5.04 -8.65 0.45 0
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386518 134982019 1 ISiO3C26H49 ABC3D26E49 -228.05 4.38 -8.71 -0.36 0
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386519 134982020 1 NSi2O3C38H63 AB2C3D38E63 -247.06 0.38 -8.85 -0.08 0
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386520 134982025 1 NSO4C28H37 ABC4D28E37 -121.86 2.39 -8.75 -0.48 0
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386521 134982026 1 SO6C22H28 AB6C22D28 -220.62 5.77 -9.56 -0.52 0
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386522 134982027 1 SiO4C27H30 AB4C27D30 -126.61 2.1 -9.0 -0.42 0
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386523 134982028 1 SiO4C14H28 AB4C14D28 -211.4 2.16 -9.22 0.62 0
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386524 134982031 1 OC17H24 AB17C24 -32.15 1.92 -8.51 0.2 0
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386525 134982036 1 FeO4C19H20 AB4C19D20 64.84 2.62 -6.42 -0.43 0
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386526 134982037 1 OC16H20 AB16C20 -9.82 3.23 -8.95 -0.51 0
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386527 134982039 1 O3C12H16 A3B12C16 -113.44 2.81 -9.15 0.27 0
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386528 134982042 1 SO4C16H18 AB4C16D18 -118.65 5.31 -9.07 -0.63 0
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386529 134982045 2 O3C10H12 A3B10C12 -182.09 3.89 -9.13 -0.36 0
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386530 134982048 1 FeNO4H15C17 ABC4D15E17 25.73 2.42 -7.39 -0.84 0
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386531 134982051 1 NO2C11H13 AB2C11D13 -36.62 4.33 -9.34 0.12 0
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386532 134982052 1 SiO5C30H52 AB5C30D52 -295.09 3.09 -8.62 0.28 0
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386533 134982063 2 SH10C14 AB10C14 168.14 3.36 -8.39 -0.58 0
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386534 134982064 1 ClPO2H18C23 ABC2D18E23 -28.05 2.8 -9.1 -0.36 0
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386535 134982065 2 H8C9 A8B9 65.05 0.33 -8.29 -0.53 0
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386536 134982066 1 SiO2C23H38 AB2C23D38 -167.41 2.06 -8.52 0.39 0
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386537 134982070 1 NO4C22H23 AB4C22D23 -82.7 3.18 -8.47 -0.49 0
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386538 134982071 1 NO4C27H31 AB4C27D31 -102.88 2.69 -8.48 -0.57 0
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386539 134982072 1 O5C15H16 A5B15C16 -169.26 2.86 -8.95 -1.1 0
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386540 134982079 1 ClO3H15C17 AB3C15D17 -74.9 4.19 -8.6 -0.57 0
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386541 134982081 2 OH7C8 AB7C8 -45.33 1.48 -8.94 -0.73 0
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386542 134982082 1 O2C15H16 A2B15C16 -55.3 1.2 -9.28 -0.21 0
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386543 134982083 1 OH20C30 AB20C30 82.14 3.4 -8.8 -1.14 0
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386544 134982085 2 ClO2H6C12 AB2C6D12 -44.2 2.73 -9.35 -1.87 0