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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148827 53788496 1 NSO3H17C19 ABC3D17E19 -66.06 8.73 -8.92 -1.1 0
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148828 53788497 2 O2C9H15 A2B9C15 -219.41 2.27 -10.26 0.78 1
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148829 53788498 1 ClN2S2O14H52C54 AB2C2D14E52F54 -455.77 6.84 0.0 0.0 0
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148830 53788499 1 ClSF2O5N6C26H33 ABC2D5E6F26G33 -284.95 5.91 -8.9 -1.34 0
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148831 53788500 1 O5C25H38 A5B25C38 -254.7 1.72 -8.66 0.47 0
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148832 53788501 1 FN2O6C32H35 AB2C6D32E35 -235.08 7.11 -8.9 -0.27 0
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148833 53788502 1 NPO5C8H16 ABC5D8E16 -265.48 5.47 -9.14 0.08 0
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148834 53788503 1 NO5C17H25 AB5C17D25 -211.57 2.26 -9.03 -0.58 0
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148835 53788504 1 O2N3C25H31 A2B3C25D31 -37.03 3.95 -8.52 -0.34 0
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148836 53788505 1 N2O2H40C51 A2B2C40D51 116.66 5.44 -8.47 -0.31 0
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148837 53788506 1 ClON2C26H29 ABC2D26E29 18.37 4.57 -8.58 -0.12 0
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148838 53788507 1 NO3C14H15 AB3C14D15 -73.57 5.15 -8.36 -0.48 0
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148839 53788508 1 O3N7C29H29 A3B7C29D29 25.96 4.79 -8.91 -0.96 0
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148840 53788509 1 BrOC20H29 ABC20D29 -62.93 3.35 -8.63 -0.38 0
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148841 53788510 1 O5C13H18 A5B13C18 -149.45 1.93 -10.01 -0.57 0
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148842 53788511 1 OSN2C10H12 ABC2D10E12 26.47 2.12 -8.81 -1.99 0
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148843 53788512 2 ClNO2C6H6 ABC2D6E6 -146.61 5.21 -9.36 -1.12 0
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148844 53788513 1 N3O3C11H17 A3B3C11D17 -96.71 3.46 -9.78 -0.28 1
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148845 53788514 1 N3O3C11H18 A3B3C11D18 -93.87 2.18 0.0 0.0 0
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148846 53788515 1 SN9O9C29H45 AB9C9D29E45 -317.66 5.37 -8.87 -0.97 0
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148847 53788516 1 ClF3O4H14C18 AB3C4D14E18 -268.36 4.77 -9.36 -0.95 0
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148848 53788517 1 SO2N7C28H31 AB2C7D28E31 60.7 4.89 -8.18 -1.03 0
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148849 53788518 1 OS2N3C15H33 AB2C3D15E33 -97.6 2.72 -8.91 0.49 0
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148850 53788519 1 BrSiN3O8C20H26 ABC3D8E20F26 -227.06 5.59 -10.0 -1.46 0
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148851 53788520 1 N2O3C18H32 A2B3C18D32 -166.69 2.25 -9.11 0.83 0