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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
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228681 87565534 1 OS2C16H20 AB2C16D20 -7.26 4.36 -8.68 0.06 0
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228682 87565535 1 OS2C16H18 AB2C16D18 3.13 3.45 -8.76 -0.06 0
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228683 87565536 1 SN3F6O6H23C26 AB3C6D6E23F26 -491.28 10.66 -10.01 -1.48 1
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228684 87565537 1 SN3F6O6H22C26 AB3C6D6E22F26 -447.76 9.33 0.0 0.0 0
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228685 87565539 1 C2N2F3H3 A2B2C3D3 -129.2 5.07 -10.13 -0.16 0
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228686 87565541 1 LiNC15H22 ABC15D22 27.04 5.75 -7.13 0.75 0
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228687 87565546 2 OC9H10 AB9C10 -40.2 6.71 -9.44 -0.93 0
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228688 87565547 1 O3H12C14 A3B12C14 -9.73 2.83 -9.27 -1.12 -4
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228690 87565551 1 O2H4N4C11 A2B4C4D11 121.13 0.9 -10.65 -2.1 0
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228691 87565552 1 PO7C18H27 AB7C18D27 -327.84 4.06 -10.09 -0.51 0
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228692 87565555 1 P2N3O15C30H55 A2B3C15D30E55 -840.09 6.12 -9.63 -0.1 0
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228693 87565556 2 NSC6H7 ABC6D7 60.41 2.58 -8.94 -0.67 0
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228694 87565557 1 Cl2O4N6C21H22 A2B4C6D21E22 -74.04 4.6 -9.01 -0.73 0
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228696 87565560 2 NO4C9H16 AB4C9D16 -389.2 5.58 -9.99 0.23 0
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228697 87565562 1 SCl2O2N13C46H47 AB2C2D13E46F47 174.15 4.43 -8.64 -0.85 1
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228698 87565564 1 N3O5C29H30 A3B5C29D30 -47.52 5.95 0.0 0.0 0
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228699 87565566 1 PF2N2O6C28H31 AB2C2D6E28F31 -363.44 3.68 -9.43 -0.37 0
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228700 87565568 1 SN4O7C23H32 AB4C7D23E32 -239.9 2.85 -9.68 -0.98 0
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228702 87565571 1 PF2N2O7C28H31 AB2C2D7E28F31 -397.21 5.85 -8.72 -0.26 0
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228703 87565572 1 PSF2N2O6C27H31 ABC2D2E6F27G31 -360.67 3.94 -9.41 -0.62 0
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228704 87565575 1 N5F6H13C16 A5B6C13D16 -237.41 7.8 -8.96 -1.06 0
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228705 87565577 1 ON2C14H14 AB2C14D14 52.01 3.23 -9.24 -0.83 0
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228706 87565578 1 ON2C14H14 AB2C14D14 51.61 2.35 -9.22 -0.81 0
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228707 87565580 1 N2O2F7H21C25 A2B2C7D21E25 -390.79 7.92 -9.57 -0.73 0
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228708 87565581 1 O4C27H44 A4B27C44 -220.54 2.77 -8.76 0.04 0