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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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328236 126700326 1 O2N7C27H31 A2B7C27D31 42.15 4.4 -7.78 -0.57 0
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328237 126700331 1 SF3N4O4H41C44 AB3C4D4E41F44 -152.04 1.75 -7.95 -0.48 0
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328238 126700336 1 SF3N4O5H35C36 AB3C4D5E35F36 -195.66 2.71 -7.96 -0.99 0
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328239 126700344 1 NOC10H23 ABC10D23 -87.83 2.66 -8.87 2.37 0
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328240 126700345 1 BrON2C12H13 ABC2D12E13 63.03 7.72 -8.62 -0.27 0
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328241 126700346 1 O10C27H48 A10B27C48 -405.59 0.44 -8.51 0.15 0
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328242 126700350 1 SN2O2C18H20 AB2C2D18E20 19.08 4.29 -8.36 -0.46 0
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328243 126700357 1 NSO4C16H25 ABC4D16E25 -196.63 4.79 -9.57 -0.73 0
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328244 126700363 1 O5C22H26 A5B22C26 -188.48 5.16 -9.62 -0.89 1
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328245 126700364 1 O6N8C43H57 A6B8C43D57 -127.27 35.96 0.0 0.0 1
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328246 126700365 1 N7O8C46H60 A7B8C46D60 -216.91 10.17 0.0 0.0 0
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328247 126700366 1 N3O3C23H27 A3B3C23D27 -49.24 6.0 -9.0 -0.48 0
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328248 126700370 2 NOC10H13 ABC10D13 -61.43 9.91 -8.3 -1.42 0
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328249 126700373 1 NF3O4C25H28 AB3C4D25E28 -324.3 3.36 -9.74 -0.85 0
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328250 126700374 1 ClO5H23C26 AB5C23D26 -147.88 0.76 -9.1 -1.24 0
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328251 126700384 1 Cl2O8N9C56H67 A2B8C9D56E67 -236.79 16.13 -7.92 -1.62 0
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328252 126700387 2 SN5O8C30H33 AB5C8D30E33 -457.26 9.33 -8.73 -2.38 0
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328253 126700390 1 O9N11C46H53 A9B11C46D53 -195.03 10.8 -7.95 -2.06 0
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328254 126700395 1 O3N5C7H15 A3B5C7D15 -90.62 4.34 -9.28 0.19 0
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328255 126700399 2 NOSC4H9 ABCD4E9 -104.7 4.85 -8.61 -0.83 0
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328256 126700411 1 N2O2C15H24 A2B2C15D24 -89.78 6.03 -8.0 0.42 0
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328257 126700418 1 O5N8C27H32 A5B8C27D32 -117.26 10.58 -8.8 -1.26 0
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328258 126700419 4 ON2C5H5 AB2C5D5 -53.13 10.42 -8.93 -1.17 0
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328259 126700425 1 N4O7C30H30 A4B7C30D30 -169.31 7.69 -9.12 -1.49 0
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328260 126700427 1 SN6O11C41H48 AB6C11D41E48 -363.15 9.13 -8.06 -1.94 0
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328261 126700429 1 O4N8H18C19 A4B8C18D19 -58.07 10.32 -8.99 -1.26 0
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328263 126700434 1 F2N3O6C18H23 A2B3C6D18E23 -331.21 5.54 -10.0 -1.08 0
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328264 126700435 1 O5N8C28H34 A5B8C28D34 -117.98 7.71 -8.8 -1.08 0
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328265 126700446 2 NH13C21 AB13C21 197.66 2.52 -8.01 -0.57 0
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328266 126700463 1 NO2C35H45 AB2C35D45 -76.35 2.3 -7.97 0.08 0
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328267 126700467 1 BrSH15C22 ABC15D22 89.75 3.24 -8.71 -0.57 0
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328268 126700468 1 NO3C30H31 AB3C30D31 23.65 4.74 -7.71 -1.24 0
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328269 126700486 1 N5H29C39 A5B29C39 199.22 3.34 -7.74 -0.55 0
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328270 126700487 1 SN4H24C33 AB4C24D33 173.8 4.8 -8.26 -0.57 0
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328271 126700488 5 NH7C9 AB7C9 218.17 1.05 -8.06 -0.42 0
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328272 126700489 1 SN4H28C40 AB4C28D40 189.01 1.1 -8.3 -0.6 0
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328273 126700490 1 O4N5C23H23 A4B5C23D23 -70.05 4.7 -8.15 -0.82 0
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328274 126700491 1 ClO3N5C21H22 AB3C5D21E22 -35.46 8.31 -8.29 -0.94 0
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328275 126700497 1 O3N5C21H23 A3B5C21D23 -40.4 4.23 -8.14 -0.74 0
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328276 126700503 1 O3N7H23C24 A3B7C23D24 20.12 5.5 -8.42 -0.76 0
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328277 126700507 1 O4N5H21C22 A4B5C21D22 -40.78 8.58 -8.49 -0.8 0
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328278 126700517 1 NC15H19 AB15C19 33.58 2.49 -8.17 0.05 0
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328279 126700518 2 FNC6H6 ABC6D6 -30.38 3.34 -9.06 -0.84 0
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328280 126700519 1 N2C11H14 A2B11C14 37.46 3.96 -9.51 -0.14 0
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328281 126700520 1 N3C11H13 A3B11C13 71.9 2.22 -9.13 -0.68 0
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328282 126700521 1 ON2C10H10 AB2C10D10 17.76 3.66 -9.56 -0.69 0
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328283 126700526 1 N2C35H38 A2B35C38 94.87 1.7 -7.94 -0.18 0
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328284 126700547 1 BrON4H13C18 ABC4D13E18 80.48 3.72 -9.01 -1.56 0
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328285 126700556 1 ClN4O4C16H23 AB4C4D16E23 -108.8 9.84 -9.65 -1.35 0
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328286 126700561 1 O4N5C30H37 A4B5C30D37 -55.22 4.35 -8.8 -0.71 0