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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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299169 117673755 1 PCl2N7O8H54C65 AB2C7D8E54F65 -82.0 11.59 -8.64 -1.27 0
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299170 117673791 1 INO3C20H20 ABC3D20E20 -72.99 4.02 -8.98 -1.38 0
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299171 117673875 1 F2N3O4H21C24 A2B3C4D21E24 -146.76 1.0 -8.48 -0.89 0
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299172 117673884 1 SCl2O5N8C26H26 AB2C5D8E26F26 -47.62 7.47 -8.19 -0.88 0
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299173 117673885 1 Cl2O3N7H21C24 A2B3C7D21E24 19.81 8.42 -8.45 -0.79 0
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299174 117673899 1 SN6O6C27H32 AB6C6D27E32 -145.79 4.11 -8.41 -0.87 0
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299175 117673909 1 N4O4H18C21 A4B4C18D21 -38.33 2.23 -9.05 -1.31 0
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299176 117673916 1 N4O4H22C23 A4B4C22D23 -56.73 4.44 -8.76 -1.2 0
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299177 117673995 1 SO4N5C19H23 AB4C5D19E23 -92.8 3.11 -8.56 -0.77 0
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299178 117674072 1 N4O6C33H40 A4B6C33D40 -192.86 8.78 -8.7 -0.87 0
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299179 117674084 1 SN3O6C29H33 AB3C6D29E33 -197.79 4.75 -8.82 -1.36 0
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299180 117674097 1 SN4O4C18H28 AB4C4D18E28 -154.31 2.64 -8.92 -0.76 0
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299181 117675097 1 O9H16F20C23 A9B16C20D23 -1364.69 4.32 -11.47 -1.02 0
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299182 117675433 1 O13C19H32 A13B19C32 -603.4 5.42 -9.91 0.17 0
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299183 117675851 1 O3N7C25H35 A3B7C25D35 -80.65 1.79 -8.23 -0.84 0
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299184 117675961 4 ON2C8H10 AB2C8D10 -57.42 2.25 -8.49 -0.96 0
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299185 117676387 1 NSCl2O4C7H13 ABC2D4E7F13 -166.37 5.01 -9.98 -1.23 0
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299186 117676619 2 NOC18H35 ABC18D35 -191.63 3.67 -8.43 0.41 0
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299188 117676688 1 ClON2H21C23 ABC2D21E23 23.51 5.87 -8.69 -0.73 0
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299189 117676779 1 BrO3N4C52H67 AB3C4D52E67 -129.96 5.61 -8.5 -2.11 0
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299190 117676812 1 N3C17H27 A3B17C27 20.19 3.14 -8.04 0.52 0
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299191 117676921 1 O3N6C32H36 A3B6C32D36 14.32 7.6 -8.81 -0.82 0
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299192 117677371 1 C5O5H12 A5B5C12 -232.04 1.88 -10.3 1.08 0
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299193 117677402 1 F3N3O4H18C22 A3B3C4D18E22 -243.84 9.33 -9.7 -1.52 0
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299194 117677403 1 SO3N7C22H27 AB3C7D22E27 -57.31 6.22 -8.82 -1.26 0
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299195 117677405 1 FSN5O5C23H26 ABC5D5E23F26 -194.0 6.18 -8.84 -1.14 0
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299196 117677544 2 O3C17H26 A3B17C26 -281.5 8.2 -8.65 -0.33 0
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299197 117677572 1 N3C26H41 A3B26C41 -15.5 1.22 -8.05 0.5 0
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299198 117677878 1 SO4N5C24H29 AB4C5D24E29 -128.55 5.56 -8.56 -1.05 0
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299199 117678229 1 FON4C11H11 ABC4D11E11 8.53 3.17 -8.93 -0.51 0
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299200 117678644 1 O10H42C49 A10B42C49 -283.16 11.89 -9.37 -1.46 0
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299201 117678802 1 F3N3O5C26H30 A3B3C5D26E30 -346.48 1.49 -9.51 -0.96 0
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299202 117679075 1 ClN3O6H16C21 AB3C6D16E21 -90.27 3.95 -9.76 -1.6 0
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299203 117679160 1 BrSN3O3C12H12 ABC3D3E12F12 -49.16 6.84 -9.61 -1.4 0
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299204 117679194 1 OF3N8C20H25 AB3C8D20E25 -127.28 2.93 -8.46 -0.64 0
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299205 117679195 1 O2F5N5H16C17 A2B5C5D16E17 -270.05 4.82 -9.24 -1.16 0
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299206 117679367 1 ClSN3O4C11H12 ABC3D4E11F12 -107.62 8.14 -10.17 -1.54 0
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299207 117679518 1 ON3C10H13 AB3C10D13 -9.83 9.13 -8.79 0.06 0
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299208 117679526 1 N3O3C15H25 A3B3C15D25 -110.47 3.07 -9.2 0.1 0
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299209 117679563 1 O5C9H14 A5B9C14 -181.28 3.28 -10.5 -0.59 0
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299210 117679884 1 ClSO2N4C23H33 ABC2D4E23F33 -120.44 5.47 -8.82 -0.61 -1
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299211 117680084 1 O2N4C8H13 A2B4C8D13 16.87 2.7 0.0 0.0 0
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299212 117680338 1 NC39H41 AB39C41 103.99 3.38 -8.1 -0.34 0
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299213 117680418 1 N4O6C41H44 A4B6C41D44 -157.23 6.64 -8.55 -0.74 0
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299214 117681098 1 N3O4C23H35 A3B4C23D35 -214.89 4.8 -9.8 0.27 0
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299215 117681099 1 N3O4C24H37 A3B4C24D37 -205.12 7.89 -9.5 -0.15 0
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299216 117681106 1 NO2C9H19 AB2C9D19 -120.03 3.64 -9.41 1.84 0
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299217 117681427 2 FO2N4C23H33 AB2C4D23E33 -295.9 6.26 -8.62 -0.67 0
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299218 117681506 1 N3O4C9H19 A3B4C9D19 -160.65 4.25 -9.31 -0.01 0
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299219 117681849 1 OPF2N2C5H5 ABC2D2E5F5 -99.62 3.2 -9.17 -0.77 0