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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
447211 135281207 1 ClN2O2C11H11 AB2C2D11E11 -33.18 8.22 -8.4 -0.38 0
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447212 135281209 1 BrClF2O3H8C10 ABC2D3E8F10 -200.15 4.67 -9.1 -1.23 0
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447213 135281223 1 ClIN4O4C20H20 ABC4D4E20F20 -72.99 7.1 -8.26 -1.08 0
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447214 135281228 1 ClO4N5C22H26 AB4C5D22E26 -93.04 2.91 -8.01 -0.5 0
Show
447215 135281238 1 ClSN5O5C24H26 ABC5D5E24F26 -101.2 9.23 -8.48 -0.67 0
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447216 135281242 1 BrClO2C11H12 ABC2D11E12 -65.7 5.1 -9.04 -1.09 0
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447217 135281262 1 ClO2N5C25H26 AB2C5D25E26 25.28 5.0 -7.94 -0.45 0
Show
447218 135281274 1 BrClO3C10H10 ABC3D10E10 -94.51 6.92 -8.72 -1.0 0
Show
447219 135281282 1 ClO2N3H14C15 AB2C3D14E15 -11.2 6.67 -8.04 -0.5 0
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447220 135281286 1 O2N5C9H13 A2B5C9D13 -55.67 3.31 -8.93 0.1 0
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447221 135281293 1 Cl2O2N7C23H23 A2B2C7D23E23 26.35 9.18 -8.09 -0.61 0
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447222 135281299 1 ClO2N8C28H33 AB2C8D28E33 39.96 7.77 -7.95 -0.48 0
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447223 135281305 1 ClSO3N4C22H25 ABC3D4E22F25 -37.59 7.98 -7.94 -0.46 0
Show
447224 135281308 1 O2N4C11H16 A2B4C11D16 -69.7 6.87 -8.56 0.42 0
Show
447225 135281311 1 N2O4C27H48 A2B4C27D48 -235.81 6.62 -9.61 -0.06 0
Show
447226 135281315 1 N2O4C21H38 A2B4C21D38 -225.72 2.55 -9.73 0.09 0
Show
447227 135281318 2 NO4C6H9 AB4C6D9 -323.18 4.9 -10.27 -0.59 0
Show
447228 135281335 2 NO4C7H11 AB4C7D11 -336.43 8.46 -9.95 -1.05 0
Show
447229 135281343 1 NSO3C6H9 ABC3D6E9 -110.32 6.41 -9.98 -0.79 0
Show
447230 135281345 1 NSO3C6H9 ABC3D6E9 -107.18 5.2 -9.89 -0.82 0
Show
447231 135281347 1 ClO4N8C32H39 AB4C8D32E39 -73.95 4.25 -8.51 -0.75 0
Show
447232 135281353 1 ClO2N7C23H24 AB2C7D23E24 36.05 7.1 -8.0 -0.45 0
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447233 135281355 1 N2O4C25H46 A2B4C25D46 -249.24 6.71 -9.94 -0.07 0
Show
447234 135281361 1 NO6H23C27 AB6C23D27 -161.71 3.47 -8.92 -0.62 0
Show
447235 135281365 1 ClN3C18H30 AB3C18D30 -35.59 4.93 -8.92 0.02 0
Show
447236 135281367 1 N2O3C11H12 A2B3C11D12 -84.41 7.51 -9.27 -0.61 0
Show
447237 135281377 1 BrClO3N4C18H20 ABC3D4E18F20 -58.64 6.35 -8.09 -1.95 0
Show
447238 135281378 1 ClSO4N5C23H28 ABC4D5E23F28 -63.84 8.38 -8.07 -0.44 0
Show
447239 135281384 1 ClO2N9C27H34 AB2C9D27E34 67.17 5.02 -8.29 -0.4 0
Show
447240 135281385 1 ClN3O5H22C25 AB3C5D22E25 -110.44 5.19 -8.67 -1.26 0
Show
447241 135281395 1 Br2O2N3C22H25 A2B2C3D22E25 -8.86 6.53 -8.03 -0.57 0
Show
447242 135281396 1 BrO2N3C22H24 AB2C3D22E24 15.11 4.7 -7.98 -0.3 0
Show
447243 135281414 1 NCl2O4C30H31 AB2C4D30E31 -111.46 6.88 -9.28 -0.76 0
Show
447244 135281422 1 O2N3F7H8C13 A2B3C7D8E13 -355.49 1.34 -10.23 -1.71 0
Show
447245 135281430 1 NCl2O4H25C26 AB2C4D25E26 -132.27 3.49 -9.38 -0.86 0
Show
447246 135281439 1 NCl2O5C29H29 AB2C5D29E29 -171.88 4.52 -9.49 -1.08 0
Show
447247 135281443 1 FNCl2O5H28C30 ABC2D5E28F30 -207.0 7.35 -9.66 -1.3 0
Show
447248 135281457 1 O2N3F5H14C15 A2B3C5D14E15 -250.35 3.28 -10.16 -1.63 0
Show
447249 135281462 1 NCl2O4H27C29 AB2C4D27E29 -100.09 6.8 -9.25 -1.19 0
Show
447250 135281473 1 ClO2N4C27H29 AB2C4D27E29 9.53 8.54 -8.18 -0.47 0
Show
447251 135281474 1 ClO2N4C27H29 AB2C4D27E29 9.55 8.57 -8.19 -0.47 0
Show
447252 135281476 1 O2N3F5H12C14 A2B3C5D12E14 -246.12 3.56 -10.16 -1.63 0
Show
447253 135281485 1 ClFO5C22H22 ABC5D22E22 -232.12 4.93 -9.91 -1.61 0
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447254 135281494 1 FSCl2N2O7C34H35 ABC2D2E7F34G35 -291.36 6.99 -9.57 -1.25 0
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447255 135281504 1 BrNCl2O4H16C23 ABC2D4E16F23 -108.81 1.83 -9.66 -1.24 0
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447256 135281506 1 Cl2N2O5C31H32 A2B2C5D31E32 -146.98 5.71 -9.41 -0.95 0
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447257 135281513 1 FCl2N2O5H21C30 AB2C2D5E21F30 -150.48 7.15 -9.66 -1.67 0
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447258 135281526 1 NCl2F2O6C33H33 AB2C2D6E33F33 -323.9 9.12 -9.56 -1.56 0
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447259 135281527 1 ClN3O3H22C24 AB3C3D22E24 -22.85 3.55 -8.65 -1.09 0
Show
447260 135281531 1 BrFNCl2O4H29C30 ABCD2E4F29G30 -174.99 3.4 -9.54 -1.24 0
Show
447261 135281544 1 O2F3N3H14C16 A2B3C3D14E16 -100.32 4.44 -9.81 -1.39 0
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447262 135281545 1 FNCl2O6C33H34 ABC2D6E33F34 -270.66 7.77 -9.38 -1.3 0
Show
447263 135281552 1 BrClFN2O2H13C22 ABCD2E2F13G22 -19.74 4.6 -9.83 -1.39 0
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447264 135281555 1 ClFO5H20C22 ABC5D20E22 -211.59 1.42 -9.88 -1.56 0
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447265 135281574 1 BrFCl2N2O3H24C29 ABC2D2E3F24G29 -79.49 8.24 -9.5 -1.19 0
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447266 135281579 1 FNCl2O6H24C29 ABC2D6E24F29 -244.24 4.98 -9.69 -1.68 0
Show
447267 135281615 1 BrNCl2O5H24C28 ABC2D5E24F28 -135.6 5.37 -9.8 -1.49 0
Show
447268 135281622 1 ClFNO4C22H23 ABCD4E22F23 -187.16 4.82 -9.04 -1.49 0
Show
447269 135281645 1 ClFO5C22H22 ABC5D22E22 -231.02 6.05 -10.14 -1.53 0
Show
447270 135281646 1 BrFNSCl2O4H15C22 ABCDE2F4G15H22 -150.31 7.05 -9.84 -1.74 0
Show
447271 135281650 1 ClN3O4C21H22 AB3C4D21E22 -99.76 7.29 -7.96 -0.47 0
Show
447272 135281661 1 ClF2O5H15C20 AB2C5D15E20 -250.5 3.93 -10.25 -1.94 0
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447273 135281698 1 ClFO4H14C17 ABC4D14E17 -184.54 5.59 -10.09 -1.48 -1
Show
447274 135281699 1 NSO6C10H12 ABC6D10E12 -126.43 3.38 0.0 0.0 0
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447275 135281714 1 BrNCl2F2O5H20C27 ABC2D2E5F20G27 -221.76 7.64 -9.65 -1.97 0
Show
447276 135281715 1 BrFN2O4C23H32 ABC2D4E23F32 -223.53 2.15 -8.98 -0.55 0
Show
447277 135281728 2 ClNO2C14H14 ABC2D14E14 -122.75 5.54 -9.4 -0.93 0
Show
447278 135281733 1 FCl2O3N5H22C30 AB2C3D5E22F30 5.94 4.43 -9.74 -1.58 0
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447279 135281734 1 ClFNO4H29C31 ABCD4E29F31 -94.33 1.97 -9.38 -1.01 0
Show
447280 135281735 1 NCl2O4C29H29 AB2C4D29E29 -112.66 6.85 -9.25 -0.85 0
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447281 135281740 1 ClF2O5H19C22 AB2C5D19E22 -257.32 1.68 -10.02 -1.48 0
Show
447282 135281741 1 NCl2O4C29H31 AB2C4D29E31 -155.82 3.2 -9.42 -0.79 0
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447283 135281755 1 OSN3C21H29 ABC3D21E29 19.47 6.43 -8.47 0.13 0
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447284 135281766 1 FO2N4C22H27 AB2C4D22E27 -73.2 4.55 -9.11 -0.38 0
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447285 135281771 1 FN3O5C28H36 AB3C5D28E36 -236.28 5.02 -8.98 -0.42 0
Show
447286 135281776 1 ClN2O4C14H17 AB2C4D14E17 -154.61 5.13 -9.31 -0.4 0
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447287 135281778 1 FN2O2C14H19 AB2C2D14E19 -105.53 4.25 -9.02 -0.27 0
Show
447288 135281780 1 FO2N4C28H31 AB2C4D28E31 -46.82 4.87 -9.39 -0.47 0
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447289 135281782 1 FO3N5C31H32 AB3C5D31E32 -46.67 5.53 -9.15 -1.19 0
Show
447290 135281783 1 FSO3N4C27H37 ABC3D4E27F37 -112.86 4.29 -8.3 -0.07 0
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447291 135281785 1 BrFSCl2N2O5H22C27 ABCD2E2F5G22H27 -172.85 6.83 -9.76 -1.65 0
Show
447292 135281792 1 FN4O4C25H31 AB4C4D25E31 -163.15 5.88 -9.12 -0.45 0
Show
447293 135281793 1 FO2N4C24H27 AB2C4D24E27 -52.38 4.47 -9.17 -0.53 0
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447294 135281802 1 FOSN3C21H28 ABCD3E21F28 -26.76 3.16 -8.34 -0.02 0
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447295 135281804 1 FN3O3C23H32 AB3C3D23E32 -162.08 8.58 -8.76 0.0 0
Show
447296 135281809 1 FO2N4C24H31 AB2C4D24E31 -71.47 2.23 -9.02 -0.19 0
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447297 135281812 1 NOC11H13 ABC11D13 13.16 2.35 -10.25 -0.27 0
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447298 135281813 1 FN3O5C28H36 AB3C5D28E36 -235.86 6.12 -8.94 -0.44 0
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447299 135281823 1 NO5C15H19 AB5C15D19 -199.35 8.1 -9.98 -0.48 0
Show
447300 135281846 1 FSO3N4C28H35 ABC3D4E28F35 -91.75 4.74 -8.4 -0.48 0
Show
447301 135281849 1 O2N5H13C15 A2B5C13D15 44.72 11.17 -8.46 -0.85 0
Show
447302 135281851 1 FSO3N4C29H37 ABC3D4E29F37 -85.16 8.25 -8.31 -0.4 0
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447303 135281864 1 OSC14H30 ABC14D30 -96.36 4.66 -7.91 0.96 0
Show
447304 135281866 1 NF3O5C12H18 AB3C5D12E18 -403.63 4.03 -10.15 -0.37 0
Show
447305 135281873 1 O2N3H5C9 A2B3C5D9 36.18 0.94 -10.79 -2.29 0
Show
447306 135281886 1 ClN4O4H25C26 AB4C4D25E26 -66.92 8.39 -8.16 -0.64 0
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447307 135281891 1 FN2O3C19H21 AB2C3D19E21 -119.55 5.55 -8.96 -0.38 0
Show
447308 135281892 1 ClO2N9C26H30 AB2C9D26E30 41.53 7.82 -7.92 -0.45 0
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447309 135281893 1 FSO3N4C27H37 ABC3D4E27F37 -107.34 2.62 -8.18 -0.3 0
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447310 135281910 1 FO3N6C31H33 AB3C6D31E33 -68.01 5.78 -8.27 -0.73 0