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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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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
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386545 134982086 2 ClOH7C14 ABC7D14 66.72 2.6 -9.15 -1.62 0
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386546 134982090 1 ClNOC17H18 ABCD17E18 1.52 5.9 -8.52 -0.1 0
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386547 134982092 1 NOH19C21 ABC19D21 36.54 1.72 -9.23 0.1 0
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386548 134982093 1 OSiC13H24 ABC13D24 -98.18 1.33 -8.72 0.26 0
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386550 134982101 1 SiO4C16H24 AB4C16D24 -201.19 2.97 -8.96 -0.76 0
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386551 134982102 1 OSiC20H40 ABC20D40 -141.34 2.27 -8.65 0.86 0
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386554 134982115 1 O3C16H20 A3B16C20 -100.66 3.61 -9.65 -0.63 0
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386555 134982132 2 OH11C12 AB11C12 -1.08 0.77 -8.7 -0.15 0
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386556 134982135 1 NSiO2C19H39 ABC2D19E39 -183.72 3.17 -8.76 0.29 0
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386557 134982136 1 NSiO2C19H39 ABC2D19E39 -183.01 2.67 -8.73 0.49 0
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386558 134982142 1 FeH18C24 AB18C24 155.55 3.51 -7.91 -1.22 0
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386559 134982150 2 H9C10 A9B10 67.25 0.66 -8.7 -0.32 0
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386560 134982154 1 OC19H20 AB19C20 18.53 1.96 -8.5 0.2 0
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386561 134982159 1 SSiO7C34H50 ABC7D34E50 -322.77 4.72 -8.81 -0.66 0
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386562 134982164 1 SSi2O7C27H50 AB2C7D27E50 -425.31 7.19 -8.62 -0.5 0
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386563 134982166 1 O3C13H18 A3B13C18 -132.8 3.91 -8.97 -0.46 0
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386564 134982169 1 O5C25H26 A5B25C26 -123.11 4.0 -9.59 -0.82 0
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386565 134982173 1 FeNSO3H13C16 ABCD3E13F16 211.38 3.94 -7.79 -0.97 0
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386566 134982174 1 FeNPO7H28C31 ABCD7E28F31 -204.85 5.52 -8.01 -0.67 -1
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386567 134982175 1 FeNPO2H24C28 ABCD2E24F28 107.62 4.62 -7.97 0.04 0
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386568 134982178 1 O11C20H22 A11B20C22 -419.76 0.86 -10.19 -1.48 0
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386569 134982179 1 O5C14H20 A5B14C20 -182.32 1.53 -9.61 -0.28 0
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386570 134982180 1 O7C34H48 A7B34C48 -296.78 5.37 -9.36 -0.01 0
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386571 134982184 1 ClOC13H17 ABC13D17 -29.31 3.62 -8.62 0.26 0
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386572 134982185 1 SiO3C16H28 AB3C16D28 -169.0 5.5 -9.32 0.57 0