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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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22404 597158 1 ClFOSN3H13C14 ABCDE3F13G14 4.33 2.83 -8.58 -0.54 0
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22405 597159 1 NiC13H18 AB13C18 120.24 3.04 -8.03 0.04 -6
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22406 597160 1 O2N3C8H11 A2B3C8D11 -69.87 6.75 -10.64 -0.24 0
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22407 597161 1 NSiC4H4F9 ABC4D4E9 -603.08 1.18 -11.18 -0.84 0
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22408 597162 1 ClSN2C14H17 ABC2D14E17 28.58 5.78 -8.82 -0.07 0
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22409 597163 2 NOC8H13 ABC8D13 -84.49 1.71 -9.62 1.03 0
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22410 597164 1 O3C9H10 A3B9C10 -113.15 8.07 -9.64 -0.59 0
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22411 597165 1 NO4C9H11 AB4C9D11 -64.74 6.6 -10.48 -1.45 0
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22412 597166 2 NOC4H5 ABC4D5 -6.0 6.9 -8.99 -0.88 0
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22413 597167 1 N2O5C10H12 A2B5C10D12 -108.59 7.37 -10.22 -1.68 0
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22414 597170 1 NO2S2C9H9 AB2C2D9E9 39.21 4.72 -9.22 -1.78 0
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22415 597171 2 NOC4H5 ABC4D5 -72.9 6.22 -8.55 -0.3 0
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22416 597172 2 NOC4H5 ABC4D5 -41.45 7.17 -9.49 -0.7 0
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22417 597174 1 NO3C14H21 AB3C14D21 -106.33 8.18 -10.1 -1.43 0
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22418 597175 1 O4C11H16 A4B11C16 -194.89 3.13 -10.8 0.25 0
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22419 597176 2 O2C6H9 A2B6C9 -195.99 3.82 -10.56 0.37 0
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22420 597177 1 OC15H26 AB15C26 -102.63 1.98 -10.07 3.0 0
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22422 597179 1 SC10H14 AB10C14 1.95 1.09 -8.3 0.13 0
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22423 597180 1 SC10H14 AB10C14 1.06 2.27 -8.48 0.03 0
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22424 597181 1 SC10H14 AB10C14 1.19 2.27 -8.51 -0.01 0
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22425 597182 1 NO4C11H15 AB4C11D15 -140.03 4.81 -8.39 0.13 0
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22426 597183 1 FN2O4H11C14 AB2C4D11E14 -61.55 0.81 -9.17 -2.05 0
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22427 597184 1 ClNOC10H12 ABCD10E12 -34.95 3.18 -9.36 -0.02 0
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22428 597185 1 NO4C29H43 AB4C29D43 -173.23 6.23 -8.21 0.29 0
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22429 597186 1 N2F3O4C14H19 A2B3C4D14E19 -336.94 7.2 -9.92 -0.04 0
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22430 597187 1 ClNO5H8C13 ABC5D8E13 -83.62 4.15 -10.0 -1.65 0
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22431 597188 1 ClNSi2C5H16 ABC2D5E16 -134.78 2.25 -9.51 0.79 0
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22432 597189 1 ClC10H11 AB10C11 14.06 2.02 -9.24 -0.23 0
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22433 597190 1 ClNSO2C9H10 ABCD2E9F10 -65.53 3.08 -9.62 -0.49 0
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22434 597191 1 N2O2C21H30 A2B2C21D30 -107.22 4.95 -9.21 -0.06 0
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22435 597192 1 SN2C8H10 AB2C8D10 34.18 2.56 -9.34 -0.57 0
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22436 597193 2 ON2C3H3 AB2C3D3 -35.62 7.88 -9.13 -0.9 0
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22437 597194 2 ON2C3H3 AB2C3D3 -42.44 4.74 -8.93 -1.08 0
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22438 597195 1 ON4C7H10 AB4C7D10 -14.7 2.94 -9.22 -0.27 0
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22439 597196 1 ON2F3C5H5 AB2C3D5E5 -176.54 4.91 -10.25 -0.37 0
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22440 597197 2 NOC4H5 ABC4D5 -37.96 7.02 -9.62 -0.81 0
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22441 597198 1 NOC10H17 ABC10D17 -60.03 2.73 -9.07 0.54 0
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22442 597199 1 NO3C9H13 AB3C9D13 -108.44 3.1 -9.47 -0.53 0
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22443 597200 1 BNOC12H24 ABCD12E24 -137.87 3.03 -8.64 1.99 0
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22444 597201 4 OC3H4 AB3C4 -189.88 4.03 -10.86 -0.8 0
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22445 597205 1 O5H14C17 A5B14C17 -164.13 1.48 -9.48 -0.87 0
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22446 597206 1 N4O5C16H20 A4B5C16D20 -141.61 4.1 -8.52 -0.68 0
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22447 597207 2 O3C8H8 A3B8C8 -214.8 2.38 -8.7 -0.07 0
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22448 597209 1 N4H6C11 A4B6C11 133.4 3.63 -9.14 -1.06 0
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22449 597216 1 O3C9H10 A3B9C10 -112.91 5.97 -9.5 -0.44 0
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22450 597218 2 O2C7H9 A2B7C9 -170.02 2.91 -9.07 -0.09 0
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22451 597228 1 BrNOSC4H4 ABCDE4F4 -0.14 3.03 -9.54 -0.96 0
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22452 597229 2 OC8H13 AB8C13 -103.78 1.28 -8.67 0.55 0
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22453 597232 1 ClOSN5C10H10 ABCD5E10F10 45.32 4.63 -9.65 -1.27 0
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22454 597253 1 ClNOC16H16 ABCD16E16 -7.06 3.46 -9.39 -0.08 0