List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
268600 103600163 1 NO3C15H15 AB3C15D15 -88.63 3.7 -9.2 -0.36 0
268601 103600164 1 INO2H14C15 ABC2D14E15 -23.87 3.84 -9.05 -0.92 0
268602 103600167 1 INO2C11H12 ABC2D11E12 -55.32 4.39 -9.07 -0.95 0
268603 103600169 1 INO3C12H14 ABC3D12E14 -103.12 5.03 -9.21 -1.07 0
268604 103600180 1 SO2N5C11H15 AB2C5D11E15 -19.76 4.34 -9.65 -1.2 0
268605 103600183 1 BrClINOH12C15 ABCDEF12G15 9.61 4.27 -9.51 -1.42 0
268606 103600187 1 INOBr2H12C15 ABCD2E12F15 21.59 4.36 -9.58 -1.43 0
268607 103600193 1 INO3C9H10 ABC3D9E10 -58.94 3.08 -9.18 -0.99 0
268608 103600195 1 O2N7H9C12 A2B7C9D12 68.14 1.22 -9.26 -1.45 0
268609 103600196 1 BrINOC17H17 ABCDE17F17 5.72 3.95 -9.28 -1.32 0
268610 103600197 1 BrINOCl2H11C15 ABCDE2F11G15 2.53 3.2 -9.51 -1.48 0
268611 103600200 1 INO2C16H16 ABC2D16E16 -44.63 3.15 -9.14 -0.99 0
268612 103600201 1 INOBr2H12C15 ABCD2E12F15 13.84 3.68 -9.28 -1.5 0
268613 103600210 1 ClN3O3H10C12 AB3C3D10E12 -99.09 7.48 -8.86 -1.08 0
268614 103600211 1 BrINOF3H8C14 ABCDE3F8G14 -131.37 1.48 -9.52 -1.57 0
268615 103600222 1 INO2H14C15 ABC2D14E15 -38.61 4.21 -9.15 -1.0 0
268616 103600224 1 FINO2H13C15 ABCD2E13F15 -81.97 3.81 -9.14 -0.98 0
268617 103600225 1 BrINOC17H17 ABCDE17F17 1.25 3.95 -9.09 -1.36 0
268618 103600226 1 FNO3H14C15 ABC3D14E15 -148.73 1.54 -9.38 -0.56 0
268619 103600229 1 ClO2N4C13H13 AB2C4D13E13 -18.79 4.71 -9.09 -1.19 0
268620 103600230 1 INOBr2H14C16 ABCD2E14F16 16.92 4.51 -9.55 -1.46 0
268621 103600232 1 BrINOH15C16 ABCDE15F16 9.93 2.8 -8.88 -1.46 0
268622 103600235 1 INO2C16H20 ABC2D16E20 -74.2 4.28 -9.09 -0.95 0
268623 103600241 1 ClO2F3N3H7C12 AB2C3D3E7F12 -183.59 2.67 -9.69 -1.69 0
268624 103600244 1 NSO3C13H13 ABC3D13E13 -95.89 2.66 -9.31 -0.53 0
268625 103600245 1 ClNO3C16H16 ABC3D16E16 -94.0 3.89 -8.96 -0.68 0
268626 103600246 1 NO4C16H17 AB4C16D17 -133.83 4.93 -8.98 -0.21 0
268627 103600248 1 NO2C13H17 AB2C13D17 -60.32 4.32 -8.72 0.23 0
268628 103600249 1 NO3C16H17 AB3C16D17 -104.0 2.93 -9.28 -0.47 0
268629 103600251 1 INO2C16H16 ABC2D16E16 -39.35 3.3 -9.15 -1.0 0
268630 103600255 1 SO2N4H6C10 AB2C4D6E10 29.19 5.05 -9.67 -1.58 0
268631 103600256 1 SO3N4H8C10 AB3C4D8E10 -57.53 2.58 -9.1 -1.53 0
268632 103600258 1 BrINOSC10H11 ABCDEF10G11 -1.21 4.11 -8.89 -1.34 0
268633 103600261 1 BrIN2O2C15H18 ABC2D2E15F18 -50.05 6.04 -9.37 -1.31 0
268634 103600265 1 NSO3C13H13 ABC3D13E13 -88.14 2.84 -9.17 -0.47 0
268635 103600272 1 NO3C17H17 AB3C17D17 -108.02 2.94 -9.28 -0.54 0
268636 103600273 1 BrNO2H16C17 ABC2D16E17 -57.24 2.86 -9.29 -0.89 0
268637 103600275 1 N4O4H8C13 A4B4C8D13 -74.89 7.29 -9.45 -1.49 0
268638 103600280 1 INO2C12H16 ABC2D12E16 -78.99 3.59 -9.14 -1.0 0
268639 103600281 1 ClO2N4H7C12 AB2C4D7E12 10.8 5.37 -9.69 -1.73 0
268640 103600282 1 O2N3C15H17 A2B3C15D17 -22.79 4.2 -9.17 -1.17 0
268641 103600283 1 BrINOC17H17 ABCDE17F17 16.28 4.24 -8.93 -1.4 0
268642 103600289 1 NOSBr2H3F4C11 ABCD2E3F4G11 -146.23 3.08 -9.85 -1.68 0
268643 103600290 1 BrNOF5H5C13 ABCD5E5F13 -208.97 3.92 -9.82 -1.26 0
268644 103600292 1 O2N3F4H7C11 A2B3C4D7E11 -207.45 1.13 -9.85 -1.33 0
268645 103600296 1 BrNOF4H6C13 ABCD4E6F13 -163.22 2.92 -9.8 -1.23 0
268646 103600308 1 BrNO2F4H4C11 ABC2D4E4F11 -186.76 3.44 -9.78 -1.32 0
268647 103600312 1 NOSF4H5C11 ABCD4E5F11 -159.0 4.42 -9.56 -1.39 0
268648 103600313 1 BrClNOF4H5C13 ABCDE4F5G13 -170.84 3.92 -9.78 -1.36 0
268649 103600314 1 OCl2N2F4H4C12 AB2C2D4E4F12 -165.33 3.03 -9.95 -1.72 0
268650 103600319 1 BrF2O2N3H6C11 AB2C2D3E6F11 -102.28 2.04 -9.59 -1.44 0
268651 103600321 1 BrNOI2H10C14 ABCD2E10F14 37.27 4.75 -8.92 -1.53 0
268652 103600322 1 INO2C11H14 ABC2D11E14 -70.23 3.29 -9.17 -1.02 0
268653 103600323 1 NO4C16H17 AB4C16D17 -129.0 4.32 -8.94 -0.42 0
268654 103600335 1 IN2O3C14H19 AB2C3D14E19 -99.83 1.85 -8.93 -1.03 0
268655 103600346 1 INO3C16H16 ABC3D16E16 -65.65 4.59 -9.09 -0.92 0
268656 103600355 1 IO2N3C15H18 AB2C3D15E18 -33.42 1.78 -9.19 -1.04 0
268657 103600356 1 BrINO2H15C16 ABCD2E15F16 -13.1 5.48 -8.96 -1.23 0
268658 103600357 1 NO4C16H17 AB4C16D17 -129.24 5.1 -9.05 -0.3 0
268659 103600359 1 BrINOC17H17 ABCDE17F17 13.97 4.15 -9.19 -1.3 0
268660 103600360 1 BrINOC17H17 ABCDE17F17 5.87 3.48 -8.71 -1.45 0
268661 103600361 1 INO2C10H10 ABC2D10E10 -37.49 3.11 -9.21 -1.05 0
268662 103600366 1 NO4C16H17 AB4C16D17 -132.59 3.53 -8.82 -0.36 0
268663 103600367 1 NO3C17H19 AB3C17D19 -112.87 3.13 -9.32 -0.51 0
268664 103600369 1 INO2C17H18 ABC2D17E18 -47.93 3.29 -9.18 -1.03 0
268665 103600371 1 FNO3H14C15 ABC3D14E15 -136.98 2.02 -9.29 -0.46 0
268666 103600380 1 NO3C16H17 AB3C16D17 -98.74 4.28 -9.15 -0.33 0
268667 103600381 1 INO2C16H16 ABC2D16E16 -35.36 3.96 -9.11 -0.97 0
268668 103600383 1 BrNO2C15H22 ABC2D15E22 -108.3 3.6 -9.22 -0.82 0
268669 103600390 1 ClNO3H12C14 ABC3D12E14 -103.32 2.24 -9.42 -0.61 0
268670 103600394 1 INO2C11H14 ABC2D11E14 -72.07 3.61 -9.16 -1.01 0
268671 103600395 1 IN2O3C13H15 AB2C3D13E15 -103.14 5.81 -9.06 -0.95 0
268672 103600408 1 ClN2O3C15H15 AB2C3D15E15 -17.89 8.04 -8.81 -1.11 0
268673 103600409 1 N3O3C14H15 A3B3C14D15 11.52 11.66 -9.05 -0.99 0
268674 103600410 1 ON2C14H16 AB2C14D16 13.35 1.33 -8.46 0.22 0