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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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384691 134977482 2 SiC13H15 AB13C15 259.91 0.12 -9.04 -1.0 0
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384692 134977483 2 NC18H22 AB18C22 201.59 4.26 -7.92 -0.66 0
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384695 134977488 2 OSiC13H25 ABC13D25 -177.92 1.26 -8.98 1.24 0
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384696 134977491 1 O4C21H32 A4B21C32 -138.6 2.23 -9.88 0.12 0
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384697 134977492 1 PS2O11C31H59 AB2C11D31E59 -674.25 3.91 -9.7 -0.64 0
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384698 134977495 1 SP2N5O8C10H15 AB2C5D8E10F15 -424.27 1.71 -9.04 -0.64 -3
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384699 134977496 1 S2P3N5O11C16H25 A2B3C5D11E16F25 -473.89 4.34 0.0 0.0 -4
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384700 134977499 1 Cl2N2P3C11H13O14 A2B2C3D11E13F14 -737.41 3.04 -9.92 -2.19 0
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384701 134977500 1 Cl2N2P3C11O14H17 A2B2C3D11E14F17 -758.9 4.74 -9.8 -0.78 0
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384702 134977503 1 NPO5C15H34 ABC5D15E34 -308.22 10.49 -9.35 -0.12 0
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384703 134977507 1 FNPO3C18H23 ABCD3E18F23 -205.86 3.55 -8.58 0.06 0
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384704 134977508 1 NPO2C23H32 ABC2D23E32 -67.92 7.49 -7.58 -0.7 0
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384705 134977513 1 ClOPN2S2C17H18 ABCD2E2F17G18 -50.28 3.47 -9.04 -0.42 0
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384706 134977514 1 OPN2S2C18H21 ABC2D2E18F21 -51.92 4.37 -8.79 -0.17 0
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384707 134977517 1 PO5C26H31 AB5C26D31 -209.5 3.21 -8.96 -0.17 0
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384708 134977519 1 SiO2C20H24 AB2C20D24 -45.1 3.01 -8.52 0.24 0
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384709 134977520 1 OH20C23 AB20C23 43.65 2.32 -8.83 -0.44 0
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384710 134977521 1 NO3C17H21 AB3C17D21 -25.74 5.3 -9.4 -1.31 0
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384711 134977522 1 SiN2C8H12 AB2C8D12 26.88 2.91 -9.96 -0.88 0
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384712 134977523 1 ClNC8H16 ABC8D16 21.0 15.58 -7.88 -0.68 1
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384713 134977524 1 NC8H16 AB8C16 48.58 1.41 0.0 0.0 0
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384715 134977530 2 C9H13 A9B13 9.26 0.84 -8.7 0.12 0
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384716 134977535 2 OH10C12 AB10C12 64.36 1.71 -7.96 -0.86 0
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384717 134977536 1 BrH17C28 AB17C28 179.88 1.85 -8.41 -1.56 0
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384719 134977542 1 NC11H13 AB11C13 60.7 3.09 -10.05 -0.06 0
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384720 134977550 4 H3C5 A3B5 216.9 1.88 -8.66 -0.71 0
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384721 134977553 2 NOH9C13 ABC9D13 149.8 8.43 -8.31 -1.51 0
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384722 134977555 1 OSiC23H32 ABC23D32 -63.05 0.19 -8.86 -0.29 0
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384723 134977562 1 SbC3O3H5F6 AB3C3D5E6 -427.28 7.71 -11.7 -2.55 0
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384724 134977563 1 F3O3H13C19 A3B3C13D19 -173.3 4.38 -9.91 -0.99 0
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384725 134977568 2 C11H14 A11B14 43.72 0.12 -8.34 0.36 0
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384726 134977572 1 S2O3F6H24C32 A2B3C6D24E32 -283.53 4.87 -9.27 -2.14 0
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384727 134977573 1 ClO3H13C18 AB3C13D18 -22.66 4.04 -9.57 -1.33 0
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384728 134977579 1 PO2C10H15 AB2C10D15 -126.25 7.58 -10.06 -0.15 1
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384729 134977582 1 PO2C26H36 AB2C26D36 -81.24 9.6 0.0 0.0 0
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384730 134977583 1 IOPC23H24 ABCD23E24 -7.83 5.98 -8.0 -0.36 0
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384731 134977584 1 IOPC26H30 ABCD26E30 -22.33 8.61 -7.72 -0.21 0
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384732 134977585 1 ClPN2O2C46H46 ABC2D2E46F46 12.42 5.61 -9.05 -0.2 0
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384733 134977586 2 BrOPH24C26 ABCD24E26 66.17 1.35 -8.27 -0.61 -1
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384734 134977588 1 ClPSN2C13H29 ABCD2E13F29 -7.26 22.14 0.0 0.0 0
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384735 134977589 1 NPS4C12H26 ABC4D12E26 25.64 8.47 -7.76 -0.78 1
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384736 134977590 1 PS4C6H12 AB4C6D12 41.69 5.75 0.0 0.0 0
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384737 134977592 1 IPO2C18H22 ABC2D18E22 -82.65 4.26 -8.56 -0.5 0
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384738 134977593 1 IPO2C18H22 ABC2D18E22 -83.73 4.21 -8.55 -0.5 0
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384739 134977594 1 BrOPC28H28 ABCD28E28 26.99 4.97 -8.46 -0.17 0
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384740 134977597 1 ClPO2C22H22 ABC2D22E22 -54.83 3.76 -9.11 -0.25 0
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384741 134977598 1 NPS2O4F6C26H28 ABC2D4E6F26G28 -433.96 16.41 -9.91 -0.77 0
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384743 134977600 1 ClPO2C10H24 ABC2D10E24 -173.69 6.11 -9.24 1.29 0
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384744 134977603 1 IPC18H20 ABC18D20 49.18 6.2 -7.95 -0.27 0
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384745 134977604 1 PSF3O3C30H36 ABC3D3E30F36 -255.1 11.96 -9.89 -0.45 0