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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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398433 135033273 1 NSO5H27C34 ABC5D27E34 -50.74 5.01 -9.94 -0.73 0
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398434 135033276 1 NO5C34H37 AB5C34D37 -103.86 3.36 -9.18 0.14 0
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398435 135033288 2 FOC6H6 ABC6D6 -148.64 3.02 -9.44 -0.4 0
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398437 135033295 1 BrOC13H15 ABC13D15 -16.1 2.43 -8.7 0.29 0
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398438 135033298 1 NSC7O8H13 ABC7D8E13 -339.93 3.29 -10.83 -1.12 0
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398439 135033299 1 N2O2H10C13 A2B2C10D13 8.95 2.45 -8.29 -1.02 0
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398440 135033313 24 CH AB 109.81 1.28 -8.1 -0.61 0
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398441 135033320 1 NS2C21H25 AB2C21D25 42.93 2.91 -8.53 -0.12 0
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398442 135033323 1 SiO5C25H40 AB5C25D40 -282.84 6.75 -9.01 -0.71 0
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398443 135033338 1 NO6C18H23 AB6C18D23 -222.0 2.39 -8.89 -0.28 0
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398444 135033339 1 NO6C18H21 AB6C18D21 -201.72 2.88 -8.98 -0.35 0
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398445 135033342 1 NO2C14H17 AB2C14D17 -85.81 4.34 -9.69 -0.79 0
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398446 135033343 1 NO2C17H17 AB2C17D17 -56.37 4.31 -9.33 -1.17 0
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398447 135033344 1 IO2H13C14 AB2C13D14 -42.02 1.65 -8.96 -0.98 0
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398448 135033345 1 NS2F3O4C15H20 AB2C3D4E15F20 -315.01 6.23 -9.44 -0.73 0
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398449 135033346 1 NSF3O4C13H22 ABC3D4E13F22 -366.1 2.96 -9.36 -0.6 0
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398450 135033347 1 NS2F3O4C19H20 AB2C3D4E19F20 -278.83 6.39 -9.06 -0.54 0
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398451 135033348 1 NS2F3O4C14H18 AB2C3D4E14F18 -305.38 3.22 -9.52 -0.84 0
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398452 135033349 1 NS2F3O4C18H24 AB2C3D4E18F24 -319.17 4.17 -9.38 -0.7 0
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398453 135033350 1 NS2F3O4C16H22 AB2C3D4E16F22 -324.46 2.1 -9.31 -0.68 0
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398454 135033351 1 NS2F3O4C17H22 AB2C3D4E17F22 -315.73 2.79 -9.52 -0.82 0
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398455 135033352 1 NS2F3O4C14H18 AB2C3D4E14F18 -302.59 1.06 -9.31 -0.54 0
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398456 135033353 1 NS2F3O4C14H18 AB2C3D4E14F18 -305.33 3.37 -9.51 -0.86 0
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398457 135033357 1 IO2C8H15 AB2C8D15 -108.38 3.42 -9.86 -1.05 0
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398458 135033358 1 ClNOH14C22 ABCD14E22 61.61 1.3 -9.41 -1.01 0
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398459 135033359 1 ClNO2H14C22 ABC2D14E22 54.14 2.53 -8.86 -1.15 0
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398460 135033371 1 SiO2C19H32 AB2C19D32 -153.44 2.1 -8.6 0.28 0
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398461 135033379 1 O16C37H46 A16B37C46 -658.28 5.52 -9.13 0.06 0
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398462 135033381 1 O15H58C62 A15B58C62 -432.91 4.99 -9.42 -0.81 0
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398463 135033383 1 NO15C48H51 AB15C48D51 -528.37 5.2 -9.09 -1.42 0
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398464 135033387 1 NOH23C25 ABC23D25 78.06 1.48 -8.66 -0.18 0
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398465 135033405 1 N3O5C15H21 A3B5C15D21 -196.2 3.26 -8.75 -0.52 0
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398466 135033407 1 N3O5C13H17 A3B5C13D17 -178.16 0.58 -8.89 -0.54 0
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398467 135033410 1 N2O6C13H16 A2B6C13D16 -220.74 5.35 -9.49 -0.76 0
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398468 135033411 1 N3O7C13H15 A3B7C13D15 -179.32 4.39 -10.71 -1.74 0
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398469 135033419 2 OH15C16 AB15C16 23.69 0.91 -8.64 -0.17 0
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398471 135033426 1 O2C3N3H4 A2B3C3D4 -31.73 2.13 0.0 0.0 0
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398472 135033430 1 N2O3H16C23 A2B3C16D23 -33.42 6.35 -8.77 -1.11 0
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398473 135033438 1 NO2C16H17 AB2C16D17 -17.52 2.47 -9.62 -0.67 0
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398474 135033456 1 F3O4C15H17 A3B4C15D17 -300.62 4.48 -8.93 -0.04 0
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398475 135033461 1 SO2C10H12 AB2C10D12 -48.35 1.03 -8.98 -0.42 0
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398476 135033462 1 NO5C18H19 AB5C18D19 -181.99 3.25 -8.78 -0.56 0
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398477 135033465 1 NF5H14C17 AB5C14D17 -164.78 4.47 -8.07 -1.02 0
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398478 135033466 8 FHC2 ABC2 -328.02 3.57 -10.02 -1.32 0
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398480 135033474 1 NO3C15H21 AB3C15D21 -51.06 5.66 -8.86 -0.3 0
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398481 135033476 1 O4C19H28 A4B19C28 -174.71 2.41 -9.23 0.46 0
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398482 135033479 1 S2N7O7C50H71 A2B7C7D50E71 -191.18 6.47 -8.1 -0.78 1
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398483 135033483 1 BrNOPH22C25 ABCDE22F25 63.14 12.68 0.0 0.0 0
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398484 135033484 1 FO5C8H13 AB5C8D13 -262.98 1.0 -9.63 0.13 0
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398485 135033486 1 SN2O4C24H32 AB2C4D24E32 -132.91 5.59 -9.26 -0.28 -1