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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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229624 87568226 1 PO4C11H23 AB4C11D23 -273.75 5.59 -10.61 -0.1 0
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229625 87568228 1 NO3C18H33 AB3C18D33 -180.12 5.18 -9.75 0.61 0
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229626 87568230 1 ClSN2O3F4H25C27 ABC2D3E4F25G27 -253.31 6.86 -8.87 -1.11 0
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229627 87568231 1 C7O8H14 A7B8C14 -353.43 5.15 -10.73 -0.2 0
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229628 87568232 1 NOC22H29 ABC22D29 -13.43 5.56 -9.25 0.08 0
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229629 87568235 2 O2C10H19 A2B10C19 -245.33 6.67 -10.62 -0.04 0
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229630 87568238 1 FN2O3C21H21 AB2C3D21E21 -81.95 5.97 -9.47 -1.25 0
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229631 87568247 1 N2O2C93H154 A2B2C93D154 -249.02 4.61 -7.6 -0.42 0
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229632 87568248 1 N3O4H29C30 A3B4C29D30 -27.47 3.2 -9.46 -0.78 0
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229633 87568252 2 NOC9H17 ABC9D17 -134.77 3.81 -9.03 0.58 0
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229634 87568266 1 FSN2O4C32H35 ABC2D4E32F35 -145.17 4.24 -8.81 -0.38 0
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229635 87568267 1 NO2C17H31 AB2C17D31 -144.29 4.75 -9.63 0.65 0
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229636 87568269 1 NO2F3C17H22 AB2C3D17E22 -246.95 6.54 -9.97 -0.78 0
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229637 87568270 1 O3C6H14 A3B6C14 -165.77 4.17 -10.12 1.98 0
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229638 87568276 1 NO2C21H35 AB2C21D35 -138.78 5.57 -9.2 0.52 0
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229639 87568277 1 N2O3C17H30 A2B3C17D30 -179.0 5.12 -9.8 -0.04 0
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229640 87568278 2 IN2C12H12 AB2C12D12 133.02 14.57 -7.56 -1.54 0
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229641 87568280 2 HOC3F5 ABC3D5 -561.87 0.83 -11.1 -1.17 0
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229642 87568284 2 I3N3O7C16H19 A3B3C7D16E19 -434.64 13.57 -9.25 -2.45 0
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229643 87568286 1 PH3O5C8F14 AB3C5D8E14 -944.34 3.08 -11.17 -1.29 0
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229644 87568288 1 SN3O4C9H13 AB3C4D9E13 -149.73 5.52 -9.65 -0.73 0
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229645 87568294 1 SO4C12H16 AB4C12D16 -147.84 3.98 -9.4 -0.5 0
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229646 87568295 1 SO4C12H16 AB4C12D16 -77.25 6.32 -9.56 -0.7 0
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229647 87568296 1 SO4C12H16 AB4C12D16 -148.47 8.66 -9.76 -0.61 0
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229648 87568301 2 OC16H32 AB16C32 -242.13 2.01 -10.49 0.9 0
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229650 87568317 1 OCl2N4C13H16 AB2C4D13E16 15.11 3.79 -9.24 -0.97 0
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229651 87568319 1 NTiCl2H26C29 ABC2D26E29 146.76 5.97 0.0 0.0 0
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229652 87568321 2 O2C7H13 A2B7C13 -231.25 8.07 -10.36 0.16 0
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229653 87568329 2 O2C6H11 A2B6C11 -218.87 6.68 -10.64 -0.07 0
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229654 87568331 1 NO4C17H29 AB4C17D29 -221.89 7.42 -10.2 0.0 0
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229655 87568332 2 NOC13H30 ABC13D30 -210.47 6.43 -9.55 2.82 0
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229656 87568335 1 Si2O3C7H14 A2B3C7D14 -77.34 16.37 -4.7 -1.18 0
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229657 87568337 1 BrClN2O3H18C19 ABC2D3E18F19 -14.78 6.09 -8.65 -0.43 0
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229658 87568339 1 OPbC6H14 ABC6D14 9.64 1.48 -5.46 -1.67 0
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229659 87568340 1 OPbC6H13 ABC6D13 -31.01 2.6 0.0 0.0 0
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229660 87568347 1 ClO4S5N8C23H23 AB4C5D8E23F23 5.1 9.95 -9.01 -1.53 0
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229662 87568353 1 P2N12O21C125H148 A2B12C21D125E148 -839.46 4.59 -8.81 -0.36 0
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229663 87568358 1 SN2O4C14H18 AB2C4D14E18 -165.06 3.13 -9.66 -0.76 0
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229664 87568367 1 BrNPF2O4C20H23 ABCD2E4F20G23 -304.8 6.67 -9.66 -0.55 0
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229665 87568371 1 FOSN2H9C10 ABCD2E9F10 -15.85 8.55 -9.12 -1.1 0
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229666 87568374 1 BrNPF2O4C24H31 ABCD2E4F24G31 -321.03 4.15 -9.45 -0.62 0
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229667 87568375 1 BrNPF2O5C20H23 ABCD2E5F20G23 -315.08 4.45 -9.62 -0.9 0
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229668 87568376 1 BrNPF2O4C24H31 ABCD2E4F24G31 -325.63 7.38 -9.49 -0.45 0
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229669 87568377 1 SN3O3F6H19C25 AB3C3D6E19F25 -292.84 6.42 -9.79 -1.78 0
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229670 87568381 1 O2N5H23C29 A2B5C23D29 84.95 1.85 -9.36 -0.91 0
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229671 87568382 1 ON3C33H45 AB3C33D45 13.73 15.49 -8.33 -1.28 0
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229672 87568397 1 N2O3F6H18C25 A2B3C6D18E25 -367.87 10.43 -9.54 -0.93 0
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229673 87568402 1 NSi2O3C10H23 AB2C3D10E23 -224.73 4.27 -7.53 -0.62 0
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229674 87568405 2 PN5O6C14H22 AB5C6D14E22 -545.28 5.3 -8.96 -0.57 1
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229675 87568407 1 FN3O5H27C31 AB3C5D27E31 -94.13 0.96 0.0 0.0 0