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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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14341 409829 2 NS2C4H7 AB2C4D7 27.81 0.08 -8.91 -0.81 0
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14342 409854 1 O2N6C14H15 A2B6C14D15 97.4 7.9 0.0 0.0 1
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14343 409855 1 ClNOC15H16 ABCD15E16 -3.2 2.6 -8.14 -0.83 0
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14344 409876 1 N5C14H15 A5B14C15 76.95 2.66 -8.52 -0.06 0
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14345 409877 2 NOC7H10 ABC7D10 -49.15 5.55 -8.91 -1.61 0
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14346 409878 2 ON2C11H18 AB2C11D18 -69.88 3.49 -8.69 -0.89 0
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14347 409882 1 SN2O4C12H32 AB2C4D12E32 -124.14 29.3 -5.6 -1.89 2
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14348 409883 1 Cl2N2C23H26 A2B2C23D26 45.05 2.37 -7.96 -0.2 0
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14349 409884 1 OH2C3N6 AB2C3D6 116.6 3.77 -11.12 -2.43 0
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14350 409886 1 NO2C10H13 AB2C10D13 -69.87 2.23 -9.67 -0.11 0
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14351 409887 1 O2N3H26C30 A2B3C26D30 164.97 5.03 0.0 0.0 1
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14352 409891 1 Cl2N2O2H5C8 A2B2C2D5E8 2.54 5.62 0.0 0.0 1
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14353 409914 1 NO3C20H25 AB3C20D25 -71.68 2.87 -8.56 -0.07 0
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14354 409918 1 ON2C19H24 AB2C19D24 5.52 1.92 -8.7 0.13 0
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14355 409925 1 NC12H18 AB12C18 29.68 1.58 0.0 0.0 1
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14356 409926 1 ClN2C18H21 AB2C18D21 38.11 1.42 -8.41 -0.03 0
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14357 409928 1 N2O2C19H28 A2B2C19D28 -79.28 1.84 -8.54 -1.34 0
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14358 410009 1 ClS2N3O4H6C7 AB2C3D4E6F7 -106.2 4.22 -9.91 -1.54 0
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14359 410102 2 SN2C7H9 AB2C7D9 67.17 3.03 -8.93 -0.49 0
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14360 410126 1 NOC23H29 ABC23D29 -7.21 1.78 -8.25 0.07 0
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14361 410153 1 NO2C25H52 AB2C25D52 -152.43 1.71 0.0 0.0 1
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14362 410164 2 N2O4C17H25 A2B4C17D25 -351.65 6.75 -8.66 -0.67 0
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14363 410188 1 NOC14H14 ABC14D14 19.2 2.1 0.0 0.0 1
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14364 410192 1 ClN2O4C16H25 AB2C4D16E25 -8.33 31.83 -5.25 -3.28 2
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14365 410209 1 NOC17H27 ABC17D27 -56.96 1.61 -8.39 0.31 0
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14366 410234 1 NO2C13H17 AB2C13D17 -54.89 4.97 -8.28 -0.12 0
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14367 410299 1 N4O8C13H16 A4B8C13D16 -64.2 2.35 -8.97 -2.91 0
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14368 410335 2 H15C19 A15B19 156.33 0.26 -8.88 -0.07 0
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14369 410349 1 NOC25H33 ABC25D33 -12.84 2.58 -8.25 0.08 0
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14370 410350 1 NO4C26H33 AB4C26D33 -146.62 4.56 -8.85 -0.7 0
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14371 410352 1 ON2C14H29 AB2C14D29 -34.41 1.28 0.0 0.0 1
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14372 410354 1 NC12H24 AB12C24 6.09 0.31 0.0 0.0 1
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14373 410367 1 NC8H16 AB8C16 8.22 1.78 0.0 0.0 1
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14374 410373 1 NC11H22 AB11C22 -0.14 0.31 0.0 0.0 1
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14375 410497 1 SN2O6C9H11 AB2C6D9E11 -190.88 7.6 0.0 0.0 1
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14377 410501 1 ON4C11H16 AB4C11D16 36.56 4.56 -8.99 -0.56 0
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14378 410502 1 OCl2N6C18H22 AB2C6D18E22 54.55 6.34 -8.98 -1.59 0
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14379 410507 1 ClH4C5N5 AB4C5D5 102.94 3.85 -10.0 -1.72 0
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14380 410508 1 ON5C13H21 AB5C13D21 -6.91 11.65 -9.24 -0.23 0
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14381 410535 1 ON4H10C12 AB4C10D12 95.22 3.87 -9.79 -1.66 0
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14382 410538 1 ON3C18H27 AB3C18D27 -19.35 1.81 -8.07 -0.43 0
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14383 410539 1 O2N3C18H25 A2B3C18D25 -49.02 3.71 -7.94 -0.35 0
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14384 410540 1 ON3C20H23 AB3C20D23 24.17 3.38 -7.93 -0.3 0
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14385 410541 1 OSN3H13C17 ABC3D13E17 58.59 0.51 -8.38 -0.99 0
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14386 410543 1 ON3C17H25 AB3C17D25 -11.15 1.81 -8.03 -0.34 0
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14387 410558 1 ON3C21H33 AB3C21D33 -29.13 2.79 -7.92 -0.35 0
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14388 410565 1 ON3C18H27 AB3C18D27 -18.0 4.2 -7.82 -0.22 0
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14389 410568 1 O2N3C22H35 A2B3C22D35 -83.34 2.9 -8.02 -0.41 0
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14390 410619 1 NO3C15H23 AB3C15D23 -119.54 4.45 -8.97 -0.38 0
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14391 410623 1 N2O3C19H30 A2B3C19D30 -139.09 3.69 -8.44 -0.38 0