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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
194445 78537286 1 BrNO4C17H18 ABC4D17E18 -91.11 7.77 -10.37 -1.56 0
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194446 78537290 1 ClS2N3O3C16H18 AB2C3D3E16F18 -75.89 6.38 -9.08 -1.45 0
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194447 78537326 1 NSO3C17H19 ABC3D17E19 -92.76 6.5 -9.32 -1.24 0
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194448 78538316 1 ClN2O5H15C19 AB2C5D15E19 -122.83 8.38 -9.15 -1.48 0
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194449 78538346 1 NO6C21H23 AB6C21D23 -195.0 6.84 -8.76 -1.07 0
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194450 78539007 1 O2N5C19H21 A2B5C19D21 32.77 4.56 -8.96 -1.43 0
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194451 78539186 1 Cl2N2O6H14C17 A2B2C6D14E17 -142.99 3.57 -9.6 -1.52 0
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194452 78539251 1 N2O6C19H20 A2B6C19D20 -121.33 11.05 -9.79 -1.19 0
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194453 78539252 1 N2O8H18C19 A2B8C18D19 -188.57 5.55 -9.02 -1.43 0
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194454 78539253 2 NO3C10H10 AB3C10D10 -126.88 9.09 -9.61 -1.12 0
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194455 78539254 2 NO3C10H10 AB3C10D10 -125.85 9.67 -8.99 -1.26 0
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194456 78539378 1 BrNO4C18H18 ABC4D18E18 -142.26 1.2 -9.09 -0.75 0
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194457 78539471 1 SN3O3C18H23 AB3C3D18E23 -102.43 4.73 -9.32 -0.51 0
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194458 78539911 1 BrNO3H14C18 ABC3D14E18 -52.17 3.93 -8.89 -0.8 0
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194459 78540299 1 FNO6H14C17 ABC6D14E17 -176.43 5.02 -9.95 -1.92 0
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194460 78540548 1 FNO5H18C20 ABC5D18E20 -200.41 6.55 -9.68 -1.42 0
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194461 78540549 1 FN2O4H15C17 AB2C4D15E17 -145.86 5.37 -9.35 -1.22 0
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194462 78540557 1 FNSO6H16C18 ABCD6E16F18 -243.23 6.97 -9.11 -1.0 0
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194463 78540558 1 FO3H19C21 AB3C19D21 -117.62 3.75 -9.48 -0.99 0
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194464 78540864 1 F3N3O5H12C16 A3B3C5D12E16 -223.75 7.24 -9.43 -1.39 0
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194465 78540960 1 N3O5C19H21 A3B5C19D21 -78.78 3.46 -9.07 -1.61 0
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194466 78540961 1 N3O4C20H23 A3B4C20D23 -49.44 4.19 -8.26 -1.55 0
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194467 78540962 1 ClN3O3C20H22 AB3C3D20E22 -83.77 4.34 -8.14 -1.24 0
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194468 78541176 1 N2O4C15H18 A2B4C15D18 -135.39 6.58 -9.37 -0.72 1
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194469 78541328 1 N3O3C13H16 A3B3C13D16 -62.31 5.13 0.0 0.0 0
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194470 78541329 1 F3N3O3H16C18 A3B3C3D16E18 -197.41 7.12 -8.94 -1.08 0
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194471 78541413 1 NSO6C9H17 ABC6D9E17 -267.1 9.94 -9.77 -0.9 0
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194472 78541755 1 FN2O6H15C18 AB2C6D15E18 -151.0 5.7 -9.02 -1.62 0
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194473 78541855 1 BrNO2H20C22 ABC2D20E22 -28.94 3.1 -8.98 -0.92 0
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194474 78542025 1 ClO2H17C22 AB2C17D22 -8.74 2.3 -9.38 -0.84 0
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194475 78542041 1 ClN2O4H19C20 AB2C4D19E20 -129.98 7.54 -8.4 -1.28 0
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194476 78542548 1 O3N4H20C23 A3B4C20D23 19.95 4.55 -9.06 -0.93 0
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194477 78542828 1 NO3C20H23 AB3C20D23 -107.45 4.88 -8.65 -0.08 0
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194478 78543081 1 NO7C21H21 AB7C21D21 -208.79 5.8 -8.4 -1.1 0
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194479 78543662 1 SN4O5C19H24 AB4C5D19E24 -142.79 13.54 -9.16 -1.02 0
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194480 78543663 1 N3O5C18H19 A3B5C18D19 -131.47 6.46 -8.35 -0.85 0
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194481 78543747 1 SN3O3H21C23 AB3C3D21E23 -26.18 4.04 -8.28 -0.49 0
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194482 78543748 1 N3O4C23H23 A3B4C23D23 -75.21 6.61 -8.46 -0.85 0
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194483 78544044 1 NO5H17C19 AB5C17D19 -136.74 6.66 -9.31 -1.38 0
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194484 78544045 1 N3O5C16H19 A3B5C16D19 -192.61 4.43 -8.99 -0.13 0
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194485 78544054 1 N3O5C20H21 A3B5C20D21 -181.15 6.06 -8.57 -0.5 0
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194486 78544055 1 N3O5C20H27 A3B5C20D27 -213.05 5.73 -8.68 -0.22 0
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194487 78544230 1 N2O5C20H20 A2B5C20D20 -74.56 4.2 -9.58 -1.6 0
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194488 78544392 1 ClN2O5H17C18 AB2C5D17E18 -106.86 4.68 -9.74 -1.64 0
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194489 78544670 1 ClN2O4C20H21 AB2C4D20E21 -142.22 3.64 -8.5 -1.22 0
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194490 78544723 1 NSO6H17C19 ABC6D17E19 -166.5 6.7 -9.41 -0.84 0
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194491 78544724 1 N2O5C20H22 A2B5C20D22 -175.72 6.83 -8.42 -0.94 1
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194492 78544725 1 OS2N5C19H26 AB2C5D19E26 67.53 6.72 0.0 0.0 0
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194493 78545115 1 NSO4C20H23 ABC4D20E23 -148.96 3.19 -8.68 -1.14 0
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194494 78545313 1 ClF2N3O3H16C19 AB2C3D3E16F19 -186.35 7.64 -8.87 -1.17 0