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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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389114 134991205 1 NSO2F3H10C14 ABC2D3E10F14 -174.08 4.07 -9.17 -1.17 0
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389115 134991223 1 RhO2C9H18 AB2C9D18 -84.2 4.59 0.0 0.0 0
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389116 134991227 1 NOBr3C4H8 ABC3D4E8 -114.5 7.94 -9.69 -1.6 0
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389117 134991229 1 MoNOBr4C10H17 ABCD4E10F17 -45.65 12.47 -7.31 -0.74 0
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389119 134991233 1 NO2H15C16 AB2C15D16 -18.45 2.92 -9.56 -0.57 0
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389121 134991238 1 O3C8H12 A3B8C12 -114.82 1.95 -10.22 -0.68 0
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389122 134991239 2 C7H9 A7B9 53.59 0.49 -9.04 0.55 0
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389123 134991240 1 O2C11H16 A2B11C16 -89.5 1.59 -9.85 0.86 0
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389124 134991244 1 O3C12H14 A3B12C14 -67.48 6.31 -9.43 -0.2 0
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389125 134991246 2 C5H9 A5B9 -23.87 0.97 -9.51 1.55 0
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389126 134991248 2 C7H13 A7B13 -41.06 0.14 -9.18 1.62 0
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389128 134991254 1 NO2C14H23 AB2C14D23 -97.48 2.72 -8.53 1.28 0
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389129 134991261 1 BC11H19 AB11C19 55.25 1.8 -7.9 0.69 0
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389132 134991270 1 PN3C20H30 AB3C20D30 34.05 2.66 -8.31 0.25 0
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389133 134991275 1 Cl2N3O6C24H35 A2B3C6D24E35 -289.41 9.17 -8.43 -1.03 0
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389135 134991277 1 N3O4C28H29 A3B4C28D29 -100.0 3.48 -8.4 -0.8 0
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389136 134991278 1 ClCuN4C8H12 ABC4D8E12 55.78 6.14 -9.32 0.44 1
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389137 134991279 1 AgC2O2 AB2C2 12.44 1.24 0.0 0.0 0
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389138 134991282 2 S2N3O4C9H12 A2B3C4D9E12 -222.6 18.41 -8.71 -1.55 0
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389139 134991284 1 AlNaN3C36H66 ABC3D36E66 -117.03 9.21 0.0 0.0 1
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389140 134991286 1 NO2C16H24 AB2C16D24 -53.86 4.46 0.0 0.0 0
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389141 134991293 1 CoN2O6C24H42 AB2C6D24E42 -276.88 21.98 0.0 0.0 0
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389142 134991298 1 CuN2O2C17H18 AB2C2D17E18 34.31 5.72 0.0 0.0 0
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389143 134991299 1 Mn2H4O10C11 A2B4C10D11 -79.67 2.35 -7.32 -2.05 -2
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389145 134991303 1 ZrS2N4O4C28H38 AB2C4D4E28F38 -12.59 8.39 -6.22 -1.48 0
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389147 134991307 2 LiN2C16H18 AB2C16D18 56.2 4.92 -6.69 -0.03 0
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389149 134991313 1 FeLi2N4C20H48 AB2C4D20E48 161.91 3.3 -3.9 1.35 0
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389151 134991325 1 IrN2P2F6C25H47 AB2C2D6E25F47 -399.72 12.56 -8.99 -4.72 0
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389152 134991328 2 NC6H11 AB6C11 6.48 1.52 -8.68 1.34 0
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389153 134991339 1 VCl2O2C6H14 AB2C2D6E14 -199.44 5.16 0.0 0.0 0
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389154 134991344 1 PdP2C24H38 AB2C24D38 39.31 1.38 -6.98 0.08 0
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389155 134991354 2 C7H13 A7B13 -43.36 0.88 -9.52 1.54 0
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389156 134991356 1 CoN4O8C24H40 AB4C8D24E40 -389.43 24.24 0.0 0.0 0
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389157 134991371 1 P2O6H38C43 A2B6C38D43 -150.38 4.61 -9.02 -0.22 0
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389158 134991372 1 P2O6C51H54 A2B6C51D54 -208.92 4.26 -8.82 -0.18 0
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389160 134991376 1 P2O6F12H56C73 A2B6C12D56E73 -684.82 6.5 -9.39 -1.38 0
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389161 134991377 1 BrMgSe ABC 3.01 0.87 0.0 0.0 1
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389162 134991378 1 MgSe AB 62.7 8.25 -7.46 -2.17 0
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389163 134991379 1 P2O3Ru3H30C31 A2B3C3D30E31 278.41 6.82 -8.75 -5.03 0
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389164 134991380 2 BNaO3 ABC3 -266.21 3.53 -7.92 0.4 0
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389165 134991382 2 PC9H14 AB9C14 -40.43 2.04 -8.17 0.34 0
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389166 134991384 1 OSi2N3C24H45 AB2C3D24E45 -136.44 6.1 -8.6 0.16 0
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389167 134991385 1 FeOP2H36C42 ABC2D36E42 63.33 23.49 -5.34 -1.22 0
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389168 134991386 1 OP2H31C37 AB2C31D37 123.44 0.51 0.0 0.0 0
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389169 134991388 1 OP2H39C41 AB2C39D41 81.78 2.33 0.0 0.0 0
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389171 134991390 1 RuSbP2O3H25F26C50 ABC2D3E25F26G50 -1199.9 16.19 -8.72 -2.81 0
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389172 134991391 1 RuSbP2O3F26H33C54 ABC2D3E26F33G54 -1214.1 12.74 -8.48 -3.01 0
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389173 134991392 2 OPF10H10C21 ABC10D10E21 -885.57 2.7 -9.16 -1.47 0
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389175 134991394 1 RuN4H12C20 AB4C12D20 492.45 3.67 -6.95 -3.07 0
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389176 134991395 1 SO3C14H20 AB3C14D20 -94.76 5.03 -9.99 -0.4 0