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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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3291 9450 1 FH7C10 AB7C10 -7.28 1.49 -9.01 -0.61 0
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3292 9454 1 PCl3O6C14H14 AB3C6D14E14 -315.47 3.92 -9.43 -1.32 0
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3293 9455 1 ClN3C8H12 AB3C8D12 11.39 3.98 -9.38 -0.26 0
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3294 9456 1 N3C8H11 A3B8C11 46.99 2.48 -8.82 0.05 0
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3295 9459 1 ClN3C14H16 AB3C14D16 36.82 3.86 -9.07 -0.12 0
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3296 9460 1 N3C14H15 A3B14C15 71.63 3.31 -8.68 -0.07 0
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3297 9461 1 FH9C12 AB9C12 -1.17 1.74 -9.24 -0.28 0
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3298 9462 1 FNH10C12 ABC10D12 -3.92 3.46 -8.44 -0.1 0
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3299 9463 1 FOH11C12 ABC11D12 -50.07 1.16 -8.62 -0.55 0
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3300 9464 1 FNOH10C12 ABCD10E12 -51.0 2.51 -8.68 -0.54 0
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3301 9465 1 FNO2C9H10 ABC2D9E10 -117.12 3.59 -9.93 -0.31 0
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3302 9466 1 FNOC10H20 ABCD10E20 -123.71 5.53 -9.48 0.98 0
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3304 9468 1 FNO2C15H22 ABC2D15E22 -131.24 1.27 -8.82 -0.82 0
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3305 9472 1 FOC15H21 ABC15D21 -96.1 3.87 -9.99 -0.57 0
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3306 9473 2 O2C5H5 A2B5C5 -136.17 1.76 -8.84 -0.23 0
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3307 9475 1 NO2C6H13 AB2C6D13 -109.9 5.4 -10.39 0.75 0
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3308 9476 1 O9C16H18 A9B16C18 -364.1 3.14 -8.97 -1.04 0
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3309 9477 1 PSO2Cl3C10H12 ABC2D3E10F12 -163.5 3.28 -9.36 -0.84 0
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3310 9478 2 ON2C7H9 AB2C7D9 16.72 1.75 -8.12 -0.57 0
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3311 9479 1 SiF2C7H8 AB2C7D8 -182.16 2.45 -9.66 -0.18 0
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3312 9480 1 NH5F6C8 AB5C6D8 -302.53 4.69 -9.43 -1.14 0
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3313 9481 1 Cl2F3H3C7 A2B3C3D7 -153.56 1.77 -10.07 -1.23 0
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3314 9482 1 F3N3H14C15 A3B3C14D15 -68.38 6.16 -8.37 -1.01 0
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3315 9483 1 NOF3H4C8 ABC3D4E8 -156.24 3.27 -9.82 -1.1 0
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3316 9484 1 O3N4C9H22 A3B4C9D22 -49.16 2.75 -8.82 -1.3 0
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3317 9488 1 ClNO3C8H12 ABC3D8E12 -149.36 3.27 -8.89 -0.25 0
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3318 9489 1 ClNO3C9H14 ABC3D9E14 -153.09 3.22 -8.93 -0.23 0
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3319 9496 3 NC3H7 AB3C7 -13.36 2.94 -9.04 1.3 0
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3320 9497 1 FNOC8H8 ABCD8E8 -32.15 1.56 -9.5 -0.37 0
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3321 9498 1 N3O3C12H13 A3B3C12D13 -3.97 7.79 -9.68 -1.59 0
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3322 9501 1 FON2C9H11 ABC2D9E11 -68.93 5.92 -9.02 -0.04 0
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3323 9503 1 NO2C14H21 AB2C14D21 -98.26 1.92 -9.03 0.36 0
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3324 9504 1 FNOC8H8 ABCD8E8 -66.98 2.36 -9.04 -0.15 0
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3325 9507 1 N6O6H18C19 A6B6C18D19 -40.03 11.83 -9.61 -1.84 0
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3326 9514 1 FON2C9H11 ABC2D9E11 -67.29 5.28 -8.84 -0.11 0
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3327 9516 1 FN3C14H14 AB3C14D14 46.26 5.53 -8.34 -0.87 0
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3328 9517 2 FOC5H9 ABC5D9 -221.69 2.9 -10.97 0.6 0
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3329 9518 1 FO2C10H19 AB2C10D19 -179.81 2.37 -10.85 0.83 0
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3330 9519 1 OF2C7H12 AB2C7D12 -158.24 1.89 -10.48 0.21 0
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3331 9520 1 FO2C7H13 AB2C7D13 -161.58 0.43 -10.93 0.75 0
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3332 9521 2 CClNH5 ABCD5 -74.64 4.86 -9.72 1.54 0
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3333 9522 1 CKNS ABCD -7.0 10.77 -7.64 -0.23 0
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3334 9523 1 BrFNC5H13 ABCD5E13 -63.41 10.52 -8.19 -0.13 0
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3335 9524 1 FNC5H13 ABC5D13 -30.01 1.93 0.0 0.0 1
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3336 9525 1 AsOC2H2Cl3 ABC2D2E3 -38.98 3.65 -11.1 -2.1 0
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3337 9526 1 SC2F3H3O3 AB2C3D3E3 -273.41 2.59 -11.95 -1.37 0
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3338 9527 1 FO2C10H19 AB2C10D19 -179.45 4.07 -10.99 0.64 0
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3339 9528 1 OC4H4F6 AB4C4D6 -367.72 0.04 -11.48 0.19 0
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3340 9529 1 OPS2C11H17 ABC2D11E17 -96.26 4.05 -8.85 -0.36 0
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3341 9530 1 FO3C10H17 AB3C10D17 -209.06 2.72 -10.56 0.2 0