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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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382202 134973193 1 BrO2N6C19H21 AB2C6D19E21 4.62 10.2 -8.7 -0.56 0
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382203 134973195 1 NO2C21H21 AB2C21D21 -26.07 1.48 -8.21 -0.93 0
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382204 134973197 2 NO2H17C19 AB2C17D19 -80.03 0.38 -8.31 -1.28 1
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382208 134973205 1 Si2O4C27H54 A2B4C27D54 -341.11 0.96 -8.84 0.18 0
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382209 134973206 1 O5C20H34 A5B20C34 -259.08 5.14 -9.91 0.4 0
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382210 134973207 1 OC15H20 AB15C20 -17.6 1.91 -9.27 0.25 0
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382211 134973208 1 O2C25H32 A2B25C32 -49.83 3.82 -9.54 0.64 0
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382212 134973210 1 NO8C12H21 AB8C12D21 -382.27 8.57 -9.71 -0.44 0
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382213 134973211 1 NO9C24H37 AB9C24D37 -402.8 5.11 -8.76 -0.66 0
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382214 134973213 1 BrO4H13C17 AB4C13D17 -95.01 3.92 -9.2 -1.1 0
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382215 134973214 1 BrO3H11C16 AB3C11D16 -48.96 5.53 -9.03 -1.3 0
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382216 134973215 1 NOC19H19 ABC19D19 13.95 4.32 -8.58 -1.03 0
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382217 134973216 1 NO3C21H40 AB3C21D40 -182.92 6.76 0.0 0.0 0
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382218 134973219 1 O3N4C25H34 A3B4C25D34 -107.46 5.96 -8.47 0.03 0
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382219 134973221 1 OC18H30 AB18C30 9.02 2.1 -8.7 0.13 0
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382220 134973224 2 O4C9H13 A4B9C13 -362.43 4.49 -9.98 0.29 0
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382221 134973225 1 O7C16H24 A7B16C24 -325.54 2.81 -10.21 0.52 0
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382222 134973227 1 NOH15C19 ABC15D19 34.93 3.45 -8.45 -1.17 0
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382223 134973228 1 O2C11H18 A2B11C18 -59.02 3.61 -9.36 0.83 0
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382224 134973231 1 SiO3C18H28 AB3C18D28 -155.76 2.87 -8.79 0.2 0
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382225 134973232 1 SiO3C18H28 AB3C18D28 -155.31 3.92 -8.62 0.15 0
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382226 134973234 1 BrN2O2C14H15 AB2C2D14E15 -3.51 4.35 -8.89 -0.69 1
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382228 134973236 2 NO2C25H26 AB2C25D26 72.99 16.37 -7.24 -1.94 0
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382229 134973237 1 NOSC5H9 ABCD5E9 -25.62 2.56 -9.38 -0.69 0
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382230 134973238 1 PN3O3H12C13 AB3C3D12E13 -76.48 4.05 -9.4 -0.64 0
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382231 134973239 1 SO3C21H24 AB3C21D24 -85.23 1.72 -8.6 -0.3 0
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382233 134973244 1 N2O10C15H26 A2B10C15D26 -401.44 2.91 -10.28 -0.65 0
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382234 134973245 1 N2O10C11H18 A2B10C11D18 -376.91 4.66 -10.7 -1.42 0
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382235 134973246 1 N2O9C11H18 A2B9C11D18 -366.73 8.59 -10.21 -0.45 0
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382236 134973248 1 O2N3C11H13 A2B3C11D13 15.86 4.65 -9.6 -0.81 0
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382237 134973250 1 O7C22H28 A7B22C28 -293.1 2.19 -9.8 -0.76 0
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382238 134973255 1 N2Si2O5C25H44 A2B2C5D25E44 -310.35 6.68 -8.9 -0.61 0
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382239 134973256 1 S2C15H22 A2B15C22 7.57 3.81 -8.37 -0.92 0
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382240 134973258 1 SC8H16 AB8C16 -26.41 2.82 -8.73 0.52 0
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382241 134973259 2 SO2N3C16H17 AB2C3D16E17 -70.96 2.47 -8.57 -0.91 0
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382242 134973260 1 O5C11H14 A5B11C14 -195.63 1.9 -9.64 -0.28 0
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382243 134973261 1 N2S4C25H26 A2B4C25D26 105.98 2.53 -8.7 -0.8 0
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382244 134973263 1 O3H18C20 A3B18C20 -14.85 2.05 -8.55 -0.5 0
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382245 134973264 1 BrNSO3C17H24 ABCD3E17F24 -63.06 2.89 -9.7 -0.17 0
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382246 134973268 1 SiO3C21H28 AB3C21D28 -137.71 2.51 -8.98 -0.09 0
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382247 134973274 1 N3O4C33H51 A3B4C33D51 -195.39 6.25 -8.7 0.45 0
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382248 134973275 1 N3O6C36H53 A3B6C36D53 -290.88 1.94 -8.83 0.28 0
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382249 134973276 1 N3O6C36H53 A3B6C36D53 -292.97 1.66 -9.01 0.32 -1
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382250 134973277 1 NSiO3C13H24 ABC3D13E24 -167.29 2.17 0.0 0.0 0
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382251 134973285 1 SiO8C39H64 AB8C39D64 -384.54 1.07 -8.79 -0.19 0
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382252 134973287 1 BrClCuLiNOSiC19H25 ABCDEFGH19I25 -11.31 7.66 -7.69 0.43 0
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382253 134973288 1 NH13C18 AB13C18 76.45 3.59 -8.79 -1.0 0
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382254 134973298 1 N2Si6O9C29H66 A2B6C9D29E66 -698.09 3.79 -9.35 0.2 0
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382255 134973301 1 O3H20C23 A3B20C23 51.93 2.57 -8.89 -0.31 0
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382256 134973302 1 N2C29H60 A2B29C60 -119.58 1.43 -8.46 2.65 0