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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149429 53789102 2 PC3O5H7 AB3C5D7 -530.91 4.85 -10.02 0.33 0
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149430 53789103 1 ClO6C8H13 AB6C8D13 -287.23 4.44 -10.67 -0.07 0
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149431 53789104 1 ClS2N4O4C13H17 AB2C4D4E13F17 -101.14 8.89 -9.37 -1.32 0
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149432 53789105 1 BrFON7H21C25 ABCD7E21F25 84.51 6.04 -8.47 -0.86 0
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149433 53789106 1 N2S2O5C8H16 A2B2C5D8E16 -165.73 5.25 -8.85 -0.46 0
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149434 53789107 1 NO2C32H65 AB2C32D65 -218.52 2.22 -8.72 0.86 0
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149435 53789108 1 PCl4N4O6C33H45 AB4C4D6E33F45 -335.91 8.83 -8.96 -1.1 0
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149436 53789109 1 SN6O6C59H66 AB6C6D59E66 -106.34 8.69 -9.06 -0.87 0
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149437 53789110 1 O2Br3H7C8 A2B3C7D8 -46.9 1.33 -9.43 -1.87 0
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149438 53789111 1 ON2C22H24 AB2C22D24 43.02 3.67 -9.3 0.0 0
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149439 53789112 1 O4C27H28 A4B27C28 -94.5 2.77 -8.5 -0.15 0
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149440 53789113 1 ClNO3C17H20 ABC3D17E20 -90.5 2.25 -8.52 -0.55 0
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149441 53789114 1 N2O5C18H28 A2B5C18D28 -227.34 3.47 -10.15 -0.34 0
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149442 53789115 1 SO5C30H54 AB5C30D54 -325.43 4.66 -9.36 -0.3 0
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149443 53789116 1 ON3C23H33 AB3C23D33 12.21 2.85 -8.54 -1.34 0
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149444 53789117 1 ON2H14C17 AB2C14D17 49.71 2.01 -8.45 -1.26 0
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149445 53789118 1 NOF2Cl4H9C14 ABC2D4E9F14 -109.1 2.18 -9.67 -0.85 0
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149446 53789119 1 ClNO5C19H20 ABC5D19E20 -167.62 4.13 -10.05 -1.2 0
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149447 53789120 1 NSO2C10H11 ABC2D10E11 -34.93 1.82 -8.71 -0.55 0
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149448 53789121 1 NO2S2C11H11 AB2C2D11E11 -44.3 6.75 -9.09 -0.93 0
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149449 53789122 1 F2N2O5C26H26 A2B2C5D26E26 -222.36 3.19 -8.83 -0.33 0
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149450 53789123 1 NO5C23H33 AB5C23D33 -199.51 4.0 -8.79 -0.74 0
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149451 53789124 1 FO4N7C29H30 AB4C7D29E30 -97.58 6.41 -8.99 -1.07 0
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149452 53789125 1 N2C17H26 A2B17C26 7.93 2.8 -8.79 0.41 0
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149453 53789126 1 NO4C16H31 AB4C16D31 -232.73 2.21 -10.18 0.3 0
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149454 53789127 1 N3O3C22H35 A3B3C22D35 -148.1 4.46 -8.83 -0.1 0
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149455 53789128 1 ClFNO3H5C10 ABCD3E5F10 -63.82 6.14 -9.78 -1.15 0
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149456 53789129 2 Br2C3H4 A2B3C4 -14.36 4.22 -10.34 -1.24 0
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149457 53789130 1 NO4C23H23 AB4C23D23 -46.53 4.5 -8.72 -1.09 0
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149458 53789131 1 ClN2O2H19C20 AB2C2D19E20 -34.76 4.76 -8.36 -0.59 0
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149459 53789132 1 PO6C23H31 AB6C23D31 -318.11 3.25 -8.78 -0.41 0
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149460 53789133 1 SN2O4H12C14 AB2C4D12E14 -109.83 1.73 -10.27 -1.12 0
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149461 53789134 1 BrSN2O3C24H25 ABC2D3E24F25 -64.06 2.08 -8.45 -0.94 0
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149462 53789135 1 SF3C12H13 AB3C12D13 -144.84 2.64 -8.69 -0.21 0
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149463 53789136 2 O4C17H22 A4B17C22 -332.42 4.6 -9.68 -0.52 0
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149464 53789137 1 O3C10H16 A3B10C16 -141.96 3.41 -10.08 -0.16 0
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149465 53789138 1 O5C24H28 A5B24C28 -187.99 5.32 -9.76 -0.18 0
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149466 53789139 1 N2O3C21H24 A2B3C21D24 -35.95 3.07 -9.01 -0.55 0
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149467 53789140 2 NC11H12 AB11C12 64.65 0.68 -8.66 -0.37 0
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149468 53789141 1 SN3O7C36H41 AB3C7D36E41 -183.17 6.79 -8.6 -0.95 0
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149469 53789142 2 SN3O3H5C7 AB3C3D5E7 -37.14 9.4 -9.24 -1.48 0
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149470 53789143 1 ClOS2H9C15 ABC2D9E15 31.61 5.92 -8.96 -1.82 1
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149471 53789144 1 SN3O7C21H34 AB3C7D21E34 -157.16 5.05 0.0 0.0 0
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149472 53789145 1 OSN3C22H29 ABC3D22E29 -19.48 5.0 -8.44 -0.13 0
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149473 53789146 20 CH AB 77.36 0.28 -9.12 -0.11 0
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149474 53789147 1 Cl2N3O3C21H23 A2B3C3D21E23 -96.94 0.84 -8.74 -0.95 0
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149475 53789148 1 OC11H18 AB11C18 -42.73 4.77 -9.35 -0.15 0
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149476 53789149 1 ClNOSC21H22 ABCDE21F22 -23.31 2.45 -9.14 -0.64 0
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149477 53789150 1 NO2C11H21 AB2C11D21 -106.88 2.41 -9.59 -0.07 0
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149478 53789151 1 SN2O4H14C18 AB2C4D14E18 -77.71 2.76 -10.08 -2.03 0