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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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163653 58106543 1 FSH15C23 ABC15D23 61.41 1.26 -8.46 -1.51 0
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163656 58106554 1 S2H14C21 A2B14C21 151.85 1.79 -7.61 -2.17 0
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163657 58106555 1 OSH14C22 ABC14D22 90.01 2.05 -8.35 -1.46 0
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163658 58106557 2 SH10C16 AB10C16 204.24 1.02 -7.62 -2.26 0
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163659 58106566 1 OSH24C27 ABC24D27 62.72 2.48 -8.32 -1.39 0
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163660 58106585 1 PdC4O4H8 AB4C4D8 -107.54 0.8 -6.94 -1.36 -1
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163661 58106600 1 NVH10C13 ABC10D13 151.53 0.73 -6.94 -0.53 -1
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163662 58106603 1 FIrNC19H23 ABCD19E23 135.47 25.64 -10.01 -5.25 -1
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163663 58106605 1 IrNPH13C16 ABCD13E16 189.65 0.88 -8.63 -4.3 0
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163664 58106611 1 NF4H19C21 AB4C19D21 -154.95 3.67 -9.09 -0.82 -1
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163665 58106619 1 IrNH10C13 ABC10D13 258.31 27.4 -9.55 -7.13 -2
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163666 58106622 2 VC2H3 AB2C3 185.2 3.5 -5.6 0.42 -1
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163667 58106623 1 FIrNOH15C17 ABCDE15F17 98.32 1.99 -8.83 -4.63 -1
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163669 58106630 1 NSC18H19 ABC18D19 43.52 1.42 -8.55 -0.31 0
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163671 58106633 1 BFIrNH18C20 ABCDE18F20 153.01 5.21 -9.09 -5.09 -2
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163673 58106637 1 FIrNH13C17 ABCD13E17 175.24 26.6 -8.98 -5.34 0
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163674 58106638 1 FNH14C17 ABC14D17 13.56 1.83 -8.89 -0.48 0
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163675 58106640 1 NOPH12C13 ABCD12E13 70.11 3.23 -9.11 -1.18 0
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163676 58106643 1 FN3O3H30C46 AB3C3D30E46 84.62 2.05 -8.68 -0.61 0
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163677 58106644 1 FN3O3H30C37 AB3C3D30E37 -22.88 2.7 -8.96 0.0 -2
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163679 58106647 1 FIrNH13C17 ABCD13E17 130.15 8.41 -8.69 -4.67 0
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163680 58106661 1 AlON2C16H17 ABC2D16E17 81.84 5.37 -8.04 -1.51 0
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163681 58106662 1 AlN2C16H17 AB2C16D17 159.05 3.12 -8.03 -0.77 0
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163683 58106665 1 N3C13H19 A3B13C19 43.41 2.33 -7.82 -0.15 0
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163684 58106667 1 NOH9C12 ABC9D12 115.06 1.32 -8.93 -1.04 -1
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163685 58106668 1 YN2F3H8C13 AB2C3D8E13 -171.41 3.56 -8.61 -1.54 0
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163686 58106669 1 N2F3H9C13 A2B3C9D13 -1.12 3.54 -9.17 -1.18 -1
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163687 58106670 1 NPtO2H10C12 ABC2D10E12 105.77 1.05 0.0 0.0 0
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163688 58106671 1 OScN2C17H20 ABC2D17E20 -67.49 7.57 0.0 0.0 0
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163689 58106682 1 NOC14H17 ABC14D17 -4.19 1.49 -9.14 0.01 0
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163691 58106703 1 NF3H14C18 AB3C14D18 -104.2 3.8 -9.26 -0.89 -2
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163693 58106706 1 VH13C14 AB13C14 127.58 3.84 -6.39 -0.13 0
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163694 58106707 14 CH AB 43.31 1.09 -8.94 0.39 0
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163695 58106713 1 FNH12C13 ABC12D13 -2.18 1.68 -9.41 -0.18 0
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163696 58106716 1 FN3O3H30C46 AB3C3D30E46 82.75 1.7 -8.82 -0.69 0
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163697 58106718 1 ON2C18H22 AB2C18D22 82.02 2.62 -8.72 -0.72 0
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163698 58106719 1 AlFNOPC17H20 ABCDEF17G20 -61.65 1.84 -8.53 -0.47 0
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163699 58106726 1 N3H33C38 A3B33C38 148.9 3.22 -9.17 -0.15 0
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163701 58106732 1 AlNSO2H8C12 ABCD2E8F12 83.35 5.84 -7.67 -1.47 0
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163702 58106733 1 FOPtN3H18C24 ABCD3E18F24 135.17 6.17 -7.96 -1.62 0
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163703 58106734 1 FON3H20C24 ABC3D20E24 23.63 5.83 -8.7 -0.6 -1
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163704 58106737 1 IrSN4C10H13 ABC4D10E13 169.94 26.73 -9.25 -5.94 -1
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163705 58106741 1 FIrN2H16C18 ABC2D16E18 190.69 27.11 -9.04 -5.31 -1
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163706 58106743 1 IrSN3C11H14 ABC3D11E14 190.96 29.66 -9.45 -7.03 0
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163707 58106748 1 FNO3H16C17 ABC3D16E17 -118.11 3.7 -9.14 -0.68 -1
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163708 58106749 1 NZrH10C13 ABC10D13 200.64 6.29 0.0 0.0 -1
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163709 58106750 1 VN2C11H13 AB2C11D13 98.59 1.03 -6.07 -0.02 0
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163710 58106754 1 NOC14H15 ABC14D15 6.87 0.76 -9.32 0.05 -1
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163712 58106756 1 NOsPH15C18 ABCD15E18 124.07 5.2 0.0 0.0 0
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163714 58874569 1 N2F3O3H13C24 A2B3C3D13E24 -87.37 6.5 -9.35 -1.61 0