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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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384746 134977605 1 O2C17H18 A2B17C18 -48.18 4.87 -9.9 -0.72 0
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384747 134977606 1 O3C15H16 A3B15C16 -79.49 3.82 -9.98 -0.76 0
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384748 134977607 1 NSO4H27C30 ABC4D27E30 -65.48 5.42 -8.81 -0.5 0
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384749 134977608 1 SN2O6H22C24 AB2C6D22E24 -89.99 2.46 -9.06 -1.94 0
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384750 134977609 1 ClNSO4H26C27 ABCD4E26F27 -94.61 7.82 -9.25 -0.59 0
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384751 134977610 1 BrPC22H32 ABC22D32 -17.22 5.54 -8.59 -0.07 0
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384752 134977611 1 NC18H19 AB18C19 68.57 2.5 -8.0 -0.04 0
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384753 134977613 1 Si3O4C39H70 A3B4C39D70 -285.16 1.43 -8.83 -0.86 0
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384754 134977616 1 NOC25H35 ABC25D35 -17.34 2.19 -8.19 0.13 0
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384755 134977617 1 NOC25H35 ABC25D35 -17.72 1.86 -8.07 0.13 0
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384757 134977619 1 ClNH7C11 ABC7D11 150.49 2.88 0.0 0.0 0
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384758 134977620 1 LiPC6O12 ABC6D12 -568.79 7.3 -11.49 -1.75 0
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384760 134977622 1 PCl3H18C20 AB3C18D20 30.37 4.72 -9.41 -1.01 0
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384761 134977623 1 PCl4H13C16 AB4C13D16 11.34 6.67 -9.59 -1.01 0
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384762 134977624 1 PO2H19C20 AB2C19D20 -38.65 1.4 -8.88 0.1 0
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384763 134977625 1 Si2O4C33H60 A2B4C33D60 -269.69 3.01 -8.74 0.14 0
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384764 134977627 1 O2Si2C57H71 A2B2C57D71 126.37 1.42 0.0 0.0 0
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384766 134977630 1 PN2O14C15H23 AB2C14D15E23 -667.24 2.89 -10.3 -0.88 -2
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384767 134977631 1 P2N3O17C18H27 A2B3C17D18E27 -729.7 6.63 -10.25 -2.89 0
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384768 134977635 1 NP2O4C8H19 AB2C4D8E19 -296.32 1.89 -9.79 0.71 0
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384769 134977636 1 NO3C19H27 AB3C19D27 -110.98 2.08 -9.1 -0.05 0
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384770 134977637 2 OH7C9 AB7C9 9.32 4.66 -9.59 -0.25 0
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384771 134977638 1 NSO3C18H27 ABC3D18E27 -107.33 5.91 -9.18 -0.13 0
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384772 134977639 1 NSO3C20H31 ABC3D20E31 -113.13 6.6 -9.19 -0.06 0
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384773 134977640 1 C15H16 A15B16 75.46 0.84 -8.8 -0.17 0
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384774 134977641 1 O3C23H36 A3B23C36 -135.52 1.87 -9.12 0.49 0
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384777 134977647 1 H18C29 A18B29 331.54 0.83 -7.63 -2.4 0
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384778 134977651 1 N2O6C29H42 A2B6C29D42 -122.65 4.81 -8.34 -2.31 0
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384779 134977652 2 OSiC14H28 ABC14D28 -192.61 3.05 -8.51 -0.34 0
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384780 134977653 2 OSiC18H36 ABC18D36 -232.94 2.3 -8.52 -0.36 0
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384781 134977654 1 O2C15H18 A2B15C18 -58.27 2.11 -8.92 0.32 0
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384782 134977660 1 O2C11H18 A2B11C18 -77.9 1.82 -9.93 1.52 0
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384783 134977662 1 SiCo2O9C25H26 AB2C9D25E26 -313.57 31.79 -9.06 -6.27 0
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384784 134977663 1 SiO3C19H26 AB3C19D26 -63.04 4.09 -8.81 -0.81 0
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384785 134977667 1 O6C23H30 A6B23C30 -232.3 4.07 -10.03 -0.55 0
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384786 134977668 1 FeO3C13H14 AB3C13D14 14.45 3.11 -8.19 0.95 0
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384787 134977669 2 C7H12 A7B12 -6.32 0.19 -8.91 0.77 0
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384788 134977671 1 O3C20H26 A3B20C26 25.14 5.26 -9.26 -1.03 0
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384790 134977674 1 SN2C18H18 AB2C18D18 92.94 2.79 -9.08 -0.97 0
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384791 134977676 2 OSSiC5H9 ABCD5E9 -90.69 4.54 -8.51 -1.51 0
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384792 134977677 1 NaH6F15C23 AB6C15D23 -623.55 3.58 -6.59 -1.5 0
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384793 134977678 1 H7F15C23 A7B15C23 -592.9 1.59 -10.62 -1.4 0
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384795 134977680 2 C9H10 A9B10 59.08 0.1 -8.27 0.35 1
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384796 134977683 21 CH AB 108.31 0.7 0.0 0.0 1
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384797 134977685 1 H23C34 A23B34 302.14 1.35 0.0 0.0 0
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384799 134977691 1 ClO2C59H60 AB2C59D60 33.0 0.69 0.0 0.0 0
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384800 134977692 1 AlO3S3Cl4C57H71 AB3C3D4E57F71 -267.88 13.36 -8.27 -2.59 0
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384801 134977693 1 O3S3C57H70 A3B3C57D70 -64.76 4.72 -8.27 -1.45 0
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384802 134977694 1 PC32H39 AB32C39 65.09 2.23 -8.22 0.22 0
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384803 134977695 1 BrO3H13C18 AB3C13D18 -9.85 5.03 -9.66 -1.12 1