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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228653 87565489 1 NH21C23 AB21C23 230.67 2.35 -9.18 -0.13 0
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228654 87565490 1 NC17H17 AB17C17 90.08 2.0 -9.19 0.14 1
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228655 87565491 1 OPC30H40 ABC30D40 -43.11 6.77 0.0 0.0 0
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228656 87565492 2 O5C7H7 A5B7C7 -85.06 5.03 -10.83 -1.89 0
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228657 87565493 1 NO2F5H10C16 AB2C5D10E16 -263.15 6.02 -9.97 -1.79 0
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228658 87565494 1 ClOF3N3C25H25 ABC3D3E25F25 -147.74 5.35 -9.34 -0.83 0
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228659 87565495 1 ClOF3N3C25H25 ABC3D3E25F25 -150.67 2.57 -9.38 -0.61 0
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228660 87565496 1 SN3F6O6H13C20 AB3C6D6E13F20 -445.5 9.5 -10.38 -1.48 0
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228661 87565498 2 O3C6H13 A3B6C13 -306.1 4.21 -10.22 0.52 0
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228662 87565499 1 O9C10H18 A9B10C18 -418.91 2.99 -10.49 -0.1 0
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228663 87565500 1 NO3F7H12C17 AB3C7D12E17 -438.03 3.18 -10.01 -1.4 0
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228664 87565506 1 ON6C25H32 AB6C25D32 95.8 3.54 -7.92 -0.22 0
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228665 87565507 2 SN3O13C36H63 AB3C13D36E63 -1303.74 7.66 -9.09 -0.03 0
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228666 87565509 1 NSO5C9H17 ABC5D9E17 -220.22 4.46 -8.52 0.24 0
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228667 87565511 1 O3H8C9 A3B8C9 -90.6 0.88 -8.66 -0.32 0
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228668 87565513 1 O3N5F7H18C23 A3B5C7D18E23 -339.68 2.68 -9.49 -1.12 0
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228669 87565515 1 F3O3H19C20 A3B3C19D20 -222.56 4.07 -8.63 -1.08 0
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228670 87565516 1 NC7H13 AB7C13 13.3 2.17 -9.07 0.33 0
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228671 87565517 1 BrNO2F7H13C18 ABC2D7E13F18 -413.04 4.4 -9.99 -1.56 0
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228672 87565518 1 F3O3N4H17C18 A3B3C4D17E18 -195.54 4.66 -8.96 -0.83 -4
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228673 87565520 1 SiZrCl2C16H26 ABC2D16E26 -101.57 9.36 -6.82 -0.93 0
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228674 87565523 1 Br2O2C15H28 A2B2C15D28 -153.3 2.84 -10.52 -1.1 0
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228676 87565526 1 NO3F9H22C27 AB3C9D22E27 -556.9 8.13 -9.18 -1.53 0
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228677 87565527 1 INO6C17H30 ABC6D17E30 -304.82 2.72 -9.96 -1.33 -4
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228679 87565529 1 O2H10C11 A2B10C11 -35.16 4.42 -9.22 -0.52 0