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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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230391 87570770 2 NC4H7 AB4C7 11.32 2.51 -8.26 0.79 0
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230392 87570771 6 OC2H3 AB2C3 -241.19 2.54 -10.34 -0.15 0
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230393 87570777 1 CSN2O2H4 ABC2D2E4 -47.82 3.27 -9.64 -1.17 0
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230394 87570779 1 SO4N5C29H43 AB4C5D29E43 -129.0 10.39 -8.66 -0.5 0
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230395 87570781 1 ClSO2N4H13C16 ABC2D4E13F16 7.85 5.77 -8.77 -0.94 0
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230396 87570787 2 O6H16C17 A6B16C17 -445.53 1.93 -8.38 -0.25 0
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230397 87570788 1 FO2H15C16 AB2C15D16 -72.16 3.54 -9.54 -0.44 0
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230398 87570793 1 FN2Cl3O4C14H14 AB2C3D4E14F14 -162.98 4.23 -9.35 -0.78 0
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230399 87570794 1 FN2Cl3O4C14H14 AB2C3D4E14F14 -163.2 0.79 -9.32 -0.75 0
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230400 87570796 1 ClSO2N4C27H37 ABC2D4E27F37 -49.33 4.67 -8.88 -0.74 0
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230401 87570798 1 NiS4O8C156H240 AB4C8D156E240 -355.86 4.78 -7.63 -3.74 0
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230402 87570800 1 ClFON7H13C15 ABCD7E13F15 31.22 5.13 -9.07 -1.32 0
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230403 87570801 1 N2O9H24C26 A2B9C24D26 -76.46 3.68 -9.27 -0.97 0
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230404 87570802 1 N2O9H24C26 A2B9C24D26 -79.48 10.06 -9.0 -0.82 0
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230405 87570806 1 O3F4N5H23C26 A3B4C5D23E26 -215.33 6.39 -8.52 -1.06 0
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230406 87570807 1 O4C11H20 A4B11C20 -191.11 2.03 -10.03 0.02 0
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230407 87570810 1 O2N5C11H13 A2B5C11D13 0.48 4.04 -9.18 -1.18 0
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230408 87570812 1 ClON6C31H43 ABC6D31E43 -12.16 4.47 -8.67 -0.8 0
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230409 87570813 1 SCl2O2N5C25H35 AB2C2D5E25F35 -49.89 5.19 -8.68 -1.23 0
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230410 87570819 1 NO5C25H31 AB5C25D31 -148.8 0.47 -9.02 -0.16 0
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230411 87570823 1 N2C23H38 A2B23C38 -47.13 2.93 -7.4 0.69 0
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230412 87570824 1 N2F4O8C21H26 A2B4C8D21E26 -502.43 7.16 -8.77 -0.45 0
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230413 87570825 1 N3C32H65 A3B32C65 -107.22 1.87 -8.52 1.36 0
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230414 87570836 1 NPO3C18H28 ABC3D18E28 -177.34 1.56 -8.8 0.55 0
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230415 87570844 1 N2O2H12C15 A2B2C12D15 3.14 4.26 -9.62 -0.6 0