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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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380815 134971380 1 F3N3O3H12C16 A3B3C3D12E16 -184.25 11.6 -9.67 -1.61 0
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380816 134971381 1 SiO5C34H48 AB5C34D48 -236.45 2.85 -8.87 -0.02 0
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380817 134971382 1 NSO10H29C34 ABC10D29E34 -303.03 5.59 -9.99 -0.89 0
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380818 134971383 1 NSiO6C34H47 ABC6D34E47 -200.44 4.41 -8.95 -0.44 0
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380819 134971385 1 ION2H17C18 ABC2D17E18 42.49 2.88 -8.17 -0.85 0
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380820 134971388 2 SiC11H12 AB11C12 14.91 0.84 -8.44 0.06 1
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380821 134971389 1 OPN3C21H31 ABC3D21E31 -57.43 2.67 0.0 0.0 0
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380822 134971390 1 O2N3C16H21 A2B3C16D21 -26.83 2.5 -9.13 -0.61 1
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380823 134971391 1 O2N3C16H22 A2B3C16D22 -13.14 4.19 0.0 0.0 0
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380824 134971392 1 SiO3C19H32 AB3C19D32 -159.64 5.33 -8.86 -0.03 0
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380825 134971394 1 SO15C87H90 AB15C87D90 -352.52 4.92 -8.51 -0.1 0
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380826 134971395 1 SO6C35H36 AB6C35D36 -155.65 3.97 -8.41 0.12 0
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380827 134971396 1 SO5C33H34 AB5C33D34 -105.33 2.33 -8.9 -0.34 0
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380828 134971397 1 SSiN6O10C66H92 ABC6D10E66F92 -417.11 9.56 -8.5 -0.57 0
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380829 134971398 2 NSO4C5H12 ABC4D5E12 -350.97 2.36 -9.46 0.13 0
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380830 134971399 2 NSO4C19H24 ABC4D19E24 -247.18 6.13 -8.6 0.05 0
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380831 134971400 2 NSO4C5H12 ABC4D5E12 -353.07 4.65 -9.17 -0.08 0
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380834 134971403 2 NO2C7H8 AB2C7D8 -129.29 5.07 -8.58 -0.73 0
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380835 134971404 1 N2F3O5H7C12 A2B3C5D7E12 -187.27 7.19 -10.89 -1.76 0
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380836 134971405 1 ClF2N3O5H18C25 AB2C3D5E18F25 -185.33 6.8 -9.41 -1.08 0
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380837 134971406 1 O2N5C10H15 A2B5C10D15 39.55 12.68 -8.76 -0.79 -2
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380838 134971407 4 NC4H5 AB4C5 137.96 3.39 -8.89 -1.1 0
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380839 134971408 2 N2C8H11 A2B8C11 136.44 2.69 -8.65 -0.44 0
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380840 134971409 2 NOC11H14 ABC11D14 -82.15 3.87 -8.89 -0.29 0
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380841 134971410 1 O2C17H28 A2B17C28 -109.02 3.04 -9.39 0.3 0
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380842 134971411 1 BrON3H16C17 ABC3D16E17 26.7 3.92 -8.31 -0.53 0
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380843 134971412 1 BrON3C18H18 ABC3D18E18 23.75 4.58 -8.26 -0.34 0
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380844 134971413 1 O5C16H22 A5B16C22 -198.01 2.94 -9.73 -0.25 0
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380845 134971415 1 BrON2C20H21 ABC2D20E21 10.54 4.9 -8.28 -0.07 0
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380846 134971417 1 PN2O11C28H45 AB2C11D28E45 -539.44 8.16 -9.21 -1.59 0
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380847 134971419 1 SO2N3C16H17 AB2C3D16E17 -19.44 3.68 -8.75 -0.83 0
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380848 134971422 1 BNSF4O4H8C10 ABCD4E4F8G10 -418.75 2.31 -9.8 -1.75 0
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380849 134971423 1 O3C17H18 A3B17C18 -74.7 2.59 -9.79 -0.1 0
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380850 134971424 1 NO2C18H21 AB2C18D21 -44.16 4.65 -9.67 0.03 0
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380851 134971425 1 NO2C18H21 AB2C18D21 -43.19 3.54 -9.67 0.01 0
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380852 134971426 2 O2C9H13 A2B9C13 -195.62 2.14 -9.59 0.1 0
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380853 134971427 1 BNSYF3O4H8C10 ABCDE3F4G8H10 -247.21 6.51 -6.13 -1.74 0
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380854 134971428 1 BNSF3O4H8C10 ABCD3E4F8G10 -284.02 1.03 0.0 0.0 0
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380855 134971429 1 O5C9H18 A5B9C18 -249.75 4.79 -10.29 -0.06 0
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380856 134971430 1 SiO3C22H34 AB3C22D34 -152.6 2.22 -8.99 0.21 0
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380857 134971431 1 SiO4C18H32 AB4C18D32 -211.96 3.13 -8.84 0.41 0
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380858 134971432 1 NO3C18H25 AB3C18D25 -133.91 1.66 -9.11 -0.1 0
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380859 134971433 1 O3C15H22 A3B15C22 -99.39 4.83 -10.16 0.24 0
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380864 134971441 1 N4O6C19H24 A4B6C19D24 -90.36 5.6 -8.49 -1.45 0
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380865 134971442 1 FeNO3C17H22 ABC3D17E22 -102.0 2.67 0.0 0.0 0
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380866 134971443 1 NO3C17H22 AB3C17D22 -75.46 2.08 0.0 0.0 0
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380867 134971444 1 FeNO3C17H22 ABC3D17E22 21.67 3.76 0.0 0.0 0
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380870 134971448 1 O3N4C19H26 A3B4C19D26 -91.46 4.51 -8.33 -0.57 0
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380871 134971450 1 NS2O7C15H29 AB2C7D15E29 -326.23 2.64 -8.74 0.06 0
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380872 134971451 1 NS2O6C14H25 AB2C6D14E25 -269.46 3.88 -8.46 0.34 0
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380873 134971452 6 OC2H2 AB2C2 -204.38 2.3 -9.04 -0.3 0
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380874 134971453 1 SN2O2H12C22 AB2C2D12E22 76.1 9.26 -9.14 -2.17 1
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380875 134971457 1 N2O6C18H25 A2B6C18D25 -191.32 4.16 0.0 0.0 0
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380876 134971458 1 BrO2C15H29 AB2C15D29 -151.08 3.74 -9.94 0.02 0
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380877 134971459 1 O2C21H22 A2B21C22 -25.25 2.83 -9.38 0.15 1
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380878 134971460 1 O2C21H21 A2B21C21 -10.35 2.68 0.0 0.0 0
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380879 134971461 1 OC45H54 AB45C54 12.38 2.76 -8.42 -0.41 0
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380880 134971462 1 O3C33H52 A3B33C52 -149.82 2.99 -9.04 -0.64 0
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380881 134971464 1 OBr2C28H40 AB2C28D40 -78.8 4.6 -9.07 -0.43 0
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380882 134971465 2 BrOC14H20 ABC14D20 -110.69 3.04 -9.16 -0.52 0
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380883 134971466 1 O2C27H44 A2B27C44 -112.91 4.23 -8.89 -0.27 0
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380884 134971467 1 O3C16H22 A3B16C22 -63.69 4.42 -10.03 -0.29 -1
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380885 134971468 1 BrH6C9 AB6C9 65.5 1.8 0.0 0.0 0
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380886 134971470 1 O5C11H18 A5B11C18 -216.64 1.86 -10.27 0.81 0
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380887 134971471 1 SiO5C18H32 AB5C18D32 -286.99 3.25 -9.18 0.09 0
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380888 134971472 1 O5C14H22 A5B14C22 -197.64 2.07 -9.0 0.9 0
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380889 134971473 1 N2O2H10C11 A2B2C10D11 0.07 4.58 -8.87 -1.17 0
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380890 134971478 1 SO4C16H24 AB4C16D24 -173.44 3.56 -8.53 -0.18 1
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380891 134971481 1 NOH16C18 ABC16D18 42.18 4.32 0.0 0.0 1
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380892 134971483 1 NOH16C18 ABC16D18 36.05 5.18 0.0 0.0 0
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380893 134971485 1 O2C21H28 A2B21C28 -67.92 3.42 -9.47 0.15 0
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380894 134971487 1 N2O5C14H14 A2B5C14D14 -99.09 7.2 -9.75 -1.57 0
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380895 134971488 1 NS2O4C11H19 AB2C4D11E19 -186.45 2.89 -8.41 0.18 0
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380896 134971495 2 OC13H21 AB13C21 -144.7 2.45 -9.08 0.05 1
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380897 134971496 1 O2C17H31 A2B17C31 -126.74 2.62 0.0 0.0 0