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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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386014 134980536 2 OH12C14 AB12C14 35.36 3.07 -8.7 -0.54 0
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386015 134980537 1 O2C19H20 A2B19C20 -26.41 1.7 -9.32 -0.73 0
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386016 134980540 1 NO6C19H21 AB6C19D21 -219.29 6.66 -9.7 -0.2 0
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386017 134980541 1 NO6C19H21 AB6C19D21 -218.21 4.44 -9.77 -0.19 0
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386019 134980545 1 O4C13H16 A4B13C16 -131.44 4.61 -9.65 -1.2 0
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386020 134980548 1 NO4C21H33 AB4C21D33 -197.55 3.33 -9.68 0.07 0
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386021 134980553 1 SiO2C11H20 AB2C11D20 -114.98 3.69 -8.6 0.43 0
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386022 134980560 1 LiO2H13C15 AB2C13D15 -89.68 4.86 -8.38 -0.01 0
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386023 134980566 1 O3C13H22 A3B13C22 -140.0 2.86 -9.44 1.18 0
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386024 134980567 1 SiO3C22H46 AB3C22D46 -269.0 3.06 -9.07 0.8 0
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386025 134980569 1 O4H32C37 A4B32C37 -35.42 2.99 -8.48 -0.14 0
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386026 134980572 1 H20C23 A20B23 90.1 0.42 -9.17 0.35 0
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386027 134980575 1 SiO2C23H40 AB2C23D40 -153.91 2.68 -8.76 0.24 0
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386028 134980576 1 SiO3C24H40 AB3C24D40 -198.84 3.04 -9.26 -0.6 0
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386029 134980577 1 N2C17H24 A2B17C24 62.86 2.39 -8.44 0.32 0
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386030 134980578 2 OSH10C11 ABC10D11 6.0 6.51 -8.5 -0.55 0
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386031 134980580 1 ClOC11H21 ABC11D21 -87.0 3.51 -9.64 0.97 0
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386032 134980581 1 OSiC27H30 ABC27D30 44.12 1.98 -9.15 0.17 0
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386034 134980583 1 AlC17H27 AB17C27 -30.85 1.18 -8.85 0.49 0
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386035 134980588 1 NC12H25 AB12C25 -27.55 2.16 -8.57 1.4 0
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386036 134980590 4 C3H4 A3B4 13.98 0.56 -8.86 0.55 0
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386037 134980593 2 C7H10 A7B10 101.84 1.3 -6.36 -1.13 0
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386038 134980594 1 C13H14 A13B14 48.12 0.53 -9.28 0.39 0
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386039 134980596 1 SO4C19H24 AB4C19D24 -160.91 2.79 -8.51 -0.04 0
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386040 134980597 1 PO7C14H25 AB7C14D25 -383.57 1.22 -10.71 0.45 0
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386041 134980599 4 C3H4 A3B4 39.47 0.54 -9.68 1.29 0
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386042 134980601 2 H16C21 A16B21 184.25 0.11 -9.18 0.21 0
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386043 134980603 1 O4C23H32 A4B23C32 -176.21 3.72 -8.96 0.33 0
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386044 134980604 1 O3C14H20 A3B14C20 -131.04 1.86 -10.01 -0.14 0
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386045 134980605 1 OC12H18 AB12C18 -28.97 1.45 -8.83 0.7 0
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386046 134980608 1 O3C22H30 A3B22C30 -84.72 1.59 -8.37 0.4 0
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386048 134980615 1 NOC24H43 ABC24D43 -97.94 3.8 -9.12 -0.07 0
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386049 134980616 1 O2C13H22 A2B13C22 -116.37 1.06 -8.69 1.74 0
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386050 134980619 10 CH2 AB2 -34.51 0.07 -9.52 1.48 0
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386051 134980623 1 SF2O2H12C13 AB2C2D12E13 -114.06 6.46 -10.3 -0.73 0
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386052 134980634 1 WO8C16H16 AB8C16D16 -73.29 0.65 -6.81 0.01 0
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386053 134980637 1 WO3C11H16 AB3C11D16 -4.33 2.62 -6.87 -0.08 0
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386054 134980649 1 NO4C18H23 AB4C18D23 -162.08 3.64 -8.86 -0.39 0
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386055 134980650 1 BrOC9H11 ABC9D11 -17.39 2.59 -10.11 -0.66 0
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386056 134980651 2 OC5H8 AB5C8 -84.33 1.81 -9.85 0.72 0
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386060 134980670 1 OSiC12H22 ABC12D22 -83.6 2.4 -9.45 0.87 0
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386061 134980671 1 O2C17H22 A2B17C22 -79.97 2.59 -9.26 -0.56 0
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386062 134980672 2 OC9H13 AB9C13 -93.93 1.72 -9.35 0.4 0
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386064 134980676 1 C11H16 A11B16 29.69 0.95 -9.16 0.26 0
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386065 134980678 2 C7H11 A7B11 73.07 0.49 -8.55 1.72 0
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386066 134980679 1 SN2O11C37H46 AB2C11D37E46 -451.23 6.75 -9.51 -0.69 0
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386067 134980681 1 OC20H34 AB20C34 -85.58 2.32 -9.2 1.32 0
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386068 134980682 2 C10H17 A10B17 -45.81 1.5 -9.11 1.48 -1
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386070 134980696 4 C3H5 A3B5 7.22 0.0 -10.31 2.61 0
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386071 134980700 1 OC13H18 AB13C18 -53.4 1.49 -9.4 0.34 -1