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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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759 3323 1 O3F6C27H38 A3B6C27D38 -478.78 2.36 -8.68 0.06 0
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760 3324 1 O4N5C14H19 A4B5C14D19 -128.76 3.77 -8.94 -0.59 0
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761 3325 1 O2S3N7C8H15 A2B3C7D8E15 -21.45 3.79 -8.49 -0.51 0
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762 3326 1 ON3C24H31 AB3C24D31 20.42 5.77 -8.6 -0.27 0
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763 3327 1 OC15H26 AB15C26 -62.85 3.6 -9.1 1.12 0
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764 3328 1 SO2C17H28 AB2C17D28 -110.25 3.07 -8.91 -0.06 0
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765 3329 1 NSO5C12H15 ABC5D12E15 -180.91 6.49 -9.4 -0.94 0
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766 3331 1 N2O4C11H14 A2B4C11D14 -160.95 3.38 -9.54 0.21 0
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767 3333 1 NCl2O4C18H19 AB2C4D18E19 -170.32 4.85 -9.04 -0.66 0
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768 3334 1 SO2N3H13C15 AB2C3D13E15 -8.25 4.61 -8.32 -0.52 0
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769 3335 1 O3H14C16 A3B14C16 -83.98 7.77 -9.73 -1.19 0
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770 3336 1 NC23H25 AB23C25 60.95 1.55 -8.99 0.32 0
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771 3337 1 NF3C12H16 AB3C12D16 -159.0 2.6 -9.03 -0.55 0
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772 3338 1 OC11H16 AB11C16 -45.64 1.93 -9.67 0.08 0
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773 3339 1 ClO4C20H21 AB4C20D21 -144.25 6.78 -9.29 -0.76 0
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774 3341 1 ClNO3C16H16 ABC3D16E16 -90.5 4.66 -8.72 -0.33 0
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775 3342 1 O3H14C15 A3B14C15 -80.39 5.38 -9.27 -0.43 0
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776 3343 1 NO4C17H21 AB4C17D21 -147.84 2.12 -8.8 0.04 0
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777 3344 1 N2O2C15H20 A2B2C15D20 -73.46 6.06 -9.02 0.27 0
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778 3345 1 ON2C22H28 AB2C22D28 -13.32 4.34 -8.6 -0.16 0
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779 3346 1 PS2O3C10H15 AB2C3D10E15 -182.68 1.28 -8.5 -0.22 0
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780 3347 1 ClNO3H22C25 ABC3D22E25 -39.0 2.32 -9.17 -0.64 0
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781 3348 1 NO4C32H39 AB4C32D39 -136.0 2.4 -8.77 -0.42 0
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782 3349 1 FN3O4H10C12 AB3C4D10E12 -181.43 4.2 -9.66 -1.06 0
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783 3350 1 N2O2C23H36 A2B2C23D36 -138.15 8.25 -9.57 0.1 0
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784 3351 1 ClN2O4C20H21 AB2C4D20E21 -100.18 2.86 -8.8 -0.39 0
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785 3353 1 N2O14C51H76 A2B14C51D76 -619.61 4.77 -9.57 -1.02 0
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786 3354 1 NO4C24H25 AB4C24D25 -109.86 3.25 -8.8 -1.13 0
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787 3355 1 N2O3F6C17H21 A2B3C6D17E21 -414.52 9.8 0.0 0.0 1
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788 3356 1 N2O3F6C17H20 A2B3C6D17E20 -424.5 3.18 -8.97 -0.95 0
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789 3357 1 F3N3O3C17H18 A3B3C3D17E18 -217.36 10.06 -9.09 -1.51 0
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790 3358 2 ON3C21H24 AB3C21D24 41.39 4.53 -7.61 -0.36 4
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792 3361 1 FS2N6O7C15H19 AB2C6D7E15F19 -216.61 9.1 -9.51 -1.24 0
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793 3362 1 O4C9H10 A4B9C10 -170.91 3.37 -9.64 -0.57 0
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794 3363 1 FN2O5C9H11 AB2C5D9E11 -252.56 5.88 -9.87 -0.67 0
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795 3364 1 ClFSN3O5H17C19 ABCD3E5F17G19 -171.66 3.05 -9.64 -1.1 0
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796 3365 1 OF2N6H12C13 AB2C6D12E13 -7.66 4.16 -10.17 -0.86 0
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797 3366 1 FON3C4H4 ABC3D4E4 -53.94 6.75 -9.44 -0.84 0
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798 3367 1 FO4N5C10H12 AB4C5D10E12 -151.72 4.09 -9.39 -0.78 0
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799 3368 1 FPN5O7C10H13 ABC5D7E10F13 -348.39 3.75 -9.48 -0.89 0
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800 3370 1 FO6C23H31 AB6C23D31 -336.19 5.63 -9.78 -0.06 0
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801 3372 1 OSF3N3C22H26 ABC3D3E22F26 -155.76 4.53 -7.95 -0.76 0
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802 3373 1 FN3O3H14C15 AB3C3D14E15 -110.95 2.75 -9.9 -1.33 0
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803 3374 1 FNO3H12C14 ABC3D12E14 -153.16 11.05 -9.4 -1.25 0
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804 3375 1 F2O5C22H28 A2B5C22D28 -310.7 8.85 -9.81 -0.47 0
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805 3378 2 FNC13H13 ABC13D13 -2.31 2.66 -8.86 -0.23 0
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806 3379 1 FO6C24H31 AB6C24D31 -309.68 8.78 -9.93 -0.61 0
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807 3381 2 FO3C12H15 AB3C12D15 -355.1 9.59 -9.94 -0.64 0
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808 3382 1 F2O7C26H32 A2B7C26D32 -401.98 8.13 -9.94 -0.64 0
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809 3383 1 O5H12C20 A5B12C20 -107.32 11.63 -9.18 -1.85 0
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810 3384 1 FO4C22H29 AB4C22D29 -226.21 7.36 -9.47 -0.77 0
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811 3386 1 NOF3C17H18 ABC3D17E18 -157.22 5.78 -9.05 -0.36 0
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812 3387 1 FO3C20H29 AB3C20D29 -220.62 6.86 -9.75 -0.03 0
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813 3389 1 SO2F3N3C29H38 AB2C3D3E29F38 -227.47 1.68 -8.14 -0.83 0
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814 3390 1 FO5C21H27 AB5C21D27 -258.61 7.66 -10.04 -0.71 0
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815 3391 1 F3O6C23H29 A3B6C23D29 -402.96 9.25 -9.47 -0.66 0
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816 3392 1 FO6C24H33 AB6C24D33 -333.95 7.87 -9.89 -0.47 0
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817 3395 1 FO4C19H19 AB4C19D19 -196.53 4.71 -9.31 -0.28 0
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818 3396 1 OF2N3C29H31 AB2C3D29E31 -68.96 3.1 -8.77 -0.07 0
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819 3397 1 N2F3O3C11H11 A2B3C3D11E11 -199.34 10.92 -9.98 -1.69 0
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820 3399 1 SF3O5C25H31 AB3C5D25E31 -361.42 10.51 -9.82 -0.53 0
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821 3400 1 ClFON2H16C19 ABCD2E16F19 -9.57 2.93 -9.19 -0.86 0
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822 3401 2 FNH8C11 ABC8D11 26.2 4.28 -9.39 -0.51 0
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823 3402 1 FNO3C24H29 ABC3D24E29 -106.19 2.2 0.0 0.0 1
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824 3404 1 N2O2F3C15H21 A2B2C3D15E21 -194.49 2.68 -9.54 -0.77 0
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825 3405 1 O6N7C19H19 A6B7C19D19 -165.62 11.03 -9.22 -1.71 0
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826 3406 2 NC2H3 AB2C3 33.79 2.46 -9.37 0.72 0
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827 3408 1 O3C19H26 A3B19C26 -145.12 4.26 -9.28 -0.23 0
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828 3409 4 OH3C4 AB3C4 -79.99 8.59 -9.0 -1.42 0
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829 3410 1 N2O4C19H24 A2B4C19D24 -130.75 5.64 -8.82 -0.28 0
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830 3411 1 N4O5C10H12 A4B5C10D12 -144.75 7.38 -9.43 -0.83 0
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831 3412 1 N7O11C22H37 A7B11C22D37 -395.21 5.5 -9.56 -0.38 0
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832 3413 1 O7C22H34 A7B22C34 -325.88 2.2 -9.87 0.09 0
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833 3414 1 CPO5 ABC5 -95.37 0.99 0.0 0.0 -3
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834 3416 2 PO4C9H11 AB4C9D11 -435.31 4.85 -9.34 -0.13 0