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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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186502 77439142 1 ON2C25H42 AB2C25D42 -55.94 3.3 -8.73 0.49 0
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186503 77439143 1 OSN2C19H26 ABC2D19E26 18.31 4.83 -8.62 0.0 0
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186504 77439148 1 ON3H13C15 AB3C13D15 44.84 7.73 -8.88 -0.64 0
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186505 77439299 1 ClO3N6C29H39 AB3C6D29E39 -76.37 6.46 -8.62 -0.42 0
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186506 77439300 1 NOSC6H9 ABCD6E9 -50.4 4.16 -8.91 0.18 0
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186507 77439306 1 ON2F4C25H30 AB2C4D25E30 -241.42 5.29 -8.77 -0.55 0
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186508 77439307 2 NOC8H12 ABC8D12 -74.83 7.11 -8.88 0.38 0
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186509 77439362 1 N3O8C25H47 A3B8C25D47 -369.43 7.84 -9.39 -0.5 0
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186510 77440023 3 NC5H7 AB5C7 30.46 7.21 -8.74 -0.51 0
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186511 77440271 1 FN3O4C26H30 AB3C4D26E30 -155.56 6.88 -8.85 -0.75 0
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186512 77440490 1 ClSO2N4C20H21 ABC2D4E20F21 -15.92 6.08 -9.32 -0.94 0
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186513 77440589 1 ClSO4N7C27H34 ABC4D7E27F34 -40.43 4.94 -8.8 -1.21 0
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186514 77440667 1 OF3N7C25H34 AB3C7D25E34 -168.34 10.32 -9.05 -0.62 1
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186515 77440711 1 BrO2N5C18H21 AB2C5D18E21 10.02 5.09 0.0 0.0 0
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186516 77441171 1 ClF3N3O5C27H27 AB3C3D5E27F27 -308.21 5.35 -9.05 -0.97 0
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186517 77441210 1 FO2N3C21H22 AB2C3D21E22 -61.35 4.36 -9.18 -0.54 0
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186518 77441211 2 NO2C9H10 AB2C9D10 -116.45 5.6 -9.63 -0.86 0
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186519 77441613 1 BrN2S2O9C20H23 AB2C2D9E20F23 -328.65 8.79 -9.75 -1.86 0
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186520 77441893 1 O11C39H70 A11B39C70 -563.63 2.48 -9.54 -0.21 0
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186521 77442108 1 N3O3H33C38 A3B3C33D38 40.64 1.52 -8.06 -1.12 0
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186522 77442109 1 FN2O4C18H21 AB2C4D18E21 -144.3 4.39 -9.29 -0.94 0
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186523 77442674 1 NO13C21H35 AB13C21D35 -572.98 5.13 -8.86 -0.2 0
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186524 77442731 1 SN4O7C32H48 AB4C7D32E48 -276.7 8.09 -9.23 0.06 0
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186525 77442744 2 NO2C10H14 AB2C10D14 -193.5 3.26 -9.63 -0.02 0
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186526 77442745 1 ClS2N5O7C37H46 AB2C5D7E37F46 -230.08 6.67 -8.64 -1.17 0