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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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313328 126613866 1 PO8C9H13 AB8C9D13 -383.99 6.37 -11.02 -0.94 0
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313329 126613868 1 P2C10O11H16 A2B10C11D16 -571.38 4.41 -11.15 -0.63 0
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313330 126613870 1 PO6C23H45 AB6C23D45 -399.79 1.96 -10.79 -0.31 0
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313332 126613874 1 PS2O4C5H9 AB2C4D5E9 -234.13 4.16 -9.48 -0.72 0
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313333 126613878 2 OC9H13 AB9C13 -31.62 0.84 -8.2 0.24 0
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313334 126613881 1 FO2N3C16H20 AB2C3D16E20 -89.29 1.7 -9.06 -1.21 0
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313335 126613883 1 NO6C20H27 AB6C20D27 -236.48 5.46 -8.66 -0.95 0
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313336 126613884 1 N3O12C38H51 A3B12C38D51 -473.47 3.76 -8.43 -0.98 0
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313337 126613886 1 SO3N6C8H26 AB3C6D8E26 -126.36 3.01 -8.83 -0.39 0
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313338 126613890 1 N2O10C39H54 A2B10C39D54 -407.61 2.96 -8.49 -0.04 0
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313339 126613892 1 N2O10C37H50 A2B10C37D50 -386.91 6.84 -8.36 -0.49 0
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313340 126613893 1 N2O10C37H50 A2B10C37D50 -392.63 4.61 -8.39 -0.56 0
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313341 126613900 1 SN3O3C4H13 AB3C3D4E13 -128.66 7.21 -9.39 0.61 0
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313342 126613926 1 N3O12C37H49 A3B12C37D49 -470.56 5.76 -8.75 -1.11 0
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313343 126613957 1 O2F3N7C31H36 A2B3C7D31E36 -162.38 6.04 -9.16 -1.02 0
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313344 126613975 1 N2O3C12H20 A2B3C12D20 -139.46 3.34 -10.0 0.23 0
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313345 126613980 2 NO2C10H15 AB2C10D15 -165.12 7.0 -9.45 0.08 0
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313346 126614034 1 FON5C26H28 ABC5D26E28 -9.12 4.73 -9.25 -0.96 0
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313347 126614037 1 OF4N6C27H28 AB4C6D27E28 -137.84 3.89 -9.3 -0.71 0
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313348 126614038 2 OF2N3C13H13 AB2C3D13E13 -164.73 3.13 -9.17 -0.58 0
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313349 126614042 1 ON6C26H28 AB6C26D28 100.62 2.98 -9.19 -0.51 0
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313350 126614046 1 O2F3N6C25H29 A2B3C6D25E29 -161.95 2.27 -8.49 -0.27 0
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313351 126614050 1 SO2N4C26H28 AB2C4D26E28 6.09 5.17 -8.25 -1.03 0
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313352 126614051 1 FSO2N4C25H25 ABC2D4E25F25 -35.11 5.46 -8.38 -1.07 0
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313353 126614052 1 O2N6C25H28 A2B6C25D28 39.41 3.94 -9.0 -0.27 0
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313354 126614053 1 O2N5C30H37 A2B5C30D37 -13.19 4.57 -8.4 0.01 0
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313355 126614055 1 SO2N4C27H28 AB2C4D27E28 32.56 3.03 -8.35 -1.06 0
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313356 126614063 1 O5C10H16 A5B10C16 -236.31 4.1 -10.55 0.54 0
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313357 126614064 1 O2N7C25H29 A2B7C25D29 52.08 1.86 -9.22 -0.51 0
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313358 126614066 2 ON3C12H13 AB3C12D13 49.85 4.76 -9.08 -0.32 0
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313359 126614069 1 SO2N4C26H28 AB2C4D26E28 1.9 7.64 -8.68 -1.19 0
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313360 126614073 1 O2N4C27H28 A2B4C27D28 13.01 3.97 -8.24 -0.67 0
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313362 126614090 1 NS3H17C24 AB3C17D24 92.33 1.89 -8.22 -0.97 0
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313363 126614103 1 O3C4H6 A3B4C6 -68.99 1.92 -9.98 0.34 0
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313364 126614107 1 NOS3H19C28 ABC3D19E28 89.19 1.64 -8.23 -1.1 0
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313365 126614122 1 N5O8C33H45 A5B8C33D45 -316.93 3.38 -9.18 -0.87 1
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313366 126614124 1 N2C16H29 A2B16C29 -15.41 3.2 0.0 0.0 0
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313367 126614126 1 SCl3N6O7C37H45 AB3C6D7E37F45 -254.25 2.02 -9.14 -0.86 0
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313368 126614133 1 NC14H31 AB14C31 -66.76 1.86 -9.12 3.55 0
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313369 126614134 1 BrON2C21H23 ABC2D21E23 44.14 5.32 -8.54 -0.58 0
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313370 126614135 1 OF3N3C14H18 AB3C3D14E18 -145.05 5.64 -8.64 -0.44 0
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313371 126614136 1 OF3N3C14H16 AB3C3D14E16 -142.49 4.85 -8.92 -0.61 0
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313372 126614138 1 OF3N3C14H16 AB3C3D14E16 -153.9 3.46 -9.2 -0.52 0
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313373 126614139 2 NOF2C8H9 ABC2D8E9 -244.8 3.42 -8.78 -0.66 0
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313374 126614140 1 PC14H27 AB14C27 -31.54 1.27 -8.18 0.7 0
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313375 126614143 1 PO6C39H75 AB6C39D75 -423.87 2.94 -9.51 0.52 0
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313376 126614160 1 I4O4H28C31 A4B4C28D31 -72.55 3.15 -8.53 -1.62 0
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313377 126614166 1 O2C27H28 A2B27C28 -33.88 1.92 -8.4 -0.77 0
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313378 126614169 1 N2O2C25H26 A2B2C25D26 -16.82 1.58 -8.75 -1.04 0
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313379 126614171 1 N2H36C49 A2B36C49 200.42 2.84 -7.75 -0.64 0