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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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146265 53661325 1 ClFO2C10H10 ABC2D10E10 -129.08 2.17 -9.69 -0.38 0
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146266 53661326 1 N4O4C19H20 A4B4C19D20 -54.88 7.08 -8.88 -1.71 0
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146267 53662097 1 O3N8C13H22 A3B8C13D22 -43.41 3.7 -8.67 -0.37 0
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146268 53662305 1 O3N5C27H31 A3B5C27D31 25.25 1.59 -8.24 -0.12 0
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146269 53662306 1 OS3C8H14 AB3C8D14 5.54 6.08 -8.6 -1.06 0
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146270 53662307 1 SN2Cl3O5H13C18 AB2C3D5E13F18 -149.72 4.88 -9.16 -1.68 0
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146271 53662462 1 S2N5O7H51C56 A2B5C7D51E56 7.95 3.24 -8.95 -0.8 1
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146272 53662663 1 N2O7C11H17 A2B7C11D17 -250.77 3.89 0.0 0.0 0
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146273 53662991 1 NO5C14H29 AB5C14D29 -248.89 5.91 -9.52 0.94 0
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146274 53663311 1 FN2O3C32H37 AB2C3D32E37 -125.07 3.86 -8.68 -0.39 1
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146275 53663364 1 SC2N4H7 AB2C4D7 82.38 5.11 0.0 0.0 0
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146276 53663436 2 NC10H15 AB10C15 116.95 3.93 -7.98 1.09 0
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146277 53663847 1 FN2O3C22H25 AB2C3D22E25 -144.97 8.4 -9.47 -0.65 0
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146278 53663888 1 NO2C16H19 AB2C16D19 -66.66 1.8 -8.53 -0.44 0
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146279 53663949 1 ON3H11C16 AB3C11D16 76.66 2.02 -9.4 -1.09 0
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146280 53664419 2 ClNSO3H8C9 ABCD3E8F9 -212.97 2.32 -9.14 -1.01 0
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146281 53664420 3 N3O3C13H19 A3B3C13D19 -393.54 12.85 -8.98 -0.61 0
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146282 53664421 1 N4O5C33H38 A4B5C33D38 -172.62 2.52 -9.05 -1.07 0
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146283 53664422 1 Cl2O4H12C13 A2B4C12D13 -137.88 5.85 -9.95 -1.25 0
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146284 53664423 1 Cl2O4H12C13 A2B4C12D13 -138.32 2.19 -9.91 -1.2 0
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146285 53664424 1 NC16H19 AB16C19 31.74 3.06 -9.25 -0.07 0
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146286 53664425 1 NOC4H9 ABC4D9 -9.63 0.44 -9.61 1.15 0
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146287 53664426 1 OSN2C19H26 ABC2D19E26 -15.86 2.69 -8.54 -0.07 0
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146288 53664427 1 N3O8C18H27 A3B8C18D27 -337.76 6.74 -9.78 -0.5 0
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146289 53664428 1 SO3N4C13H24 AB3C4D13E24 -99.94 2.83 -8.41 -0.4 0