List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
268500 103599663 1 ON6C26H28 AB6C26D28 80.14 5.72 -8.75 -0.59 0
268501 103599664 1 SO2N5C23H25 AB2C5D23E25 27.35 7.23 -8.79 -0.91 0
268502 103599665 1 SO2N7H21C22 AB2C7D21E22 96.22 5.51 -9.15 -1.33 0
268503 103599669 1 SN3O4C21H27 AB3C4D21E27 -94.08 0.32 -8.89 -1.12 0
268504 103599670 1 SO3N4C21H28 AB3C4D21E28 -44.37 6.8 -8.99 -0.88 0
268505 103599672 1 SN3O3C22H35 AB3C3D22E35 -104.17 4.81 -8.8 -0.86 0
268506 103599674 1 SO3N4C21H34 AB3C4D21E34 -95.67 4.66 -8.33 -1.0 0
268507 103599677 1 O2N6C23H24 A2B6C23D24 62.16 3.84 -8.49 -0.81 0
268508 103599678 1 ON7C23H23 AB7C23D23 115.15 3.38 -9.1 -1.02 0
268509 103599685 1 SO2N4C18H30 AB2C4D18E30 -39.09 1.23 -8.8 -0.12 0
268510 103599686 1 ClSO2N4C19H23 ABC2D4E19F23 -38.72 6.7 -9.01 -1.38 0
268511 103599689 1 N3O4H21C23 A3B4C21D23 -76.43 4.94 -8.82 -0.97 0
268512 103599700 1 O2N4C25H26 A2B4C25D26 2.49 5.52 -9.15 -0.46 0
268513 103599705 1 O2N5C24H25 A2B5C24D25 12.82 4.28 -9.29 -0.76 0
268514 103599706 1 ClO2N4C21H25 AB2C4D21E25 -45.15 1.45 -9.09 -0.41 0
268515 103599709 1 FSN2O3C22H25 ABC2D3E22F25 -89.75 4.86 -9.5 -1.0 0
268516 103599711 1 O3N4C24H34 A3B4C24D34 -107.67 4.16 -8.65 -0.46 0
268517 103599722 1 O2N5C25H29 A2B5C25D29 22.63 4.76 -8.93 -0.78 0
268518 103599741 1 ON5C26H39 AB5C26D39 -5.37 4.47 -8.53 -0.13 0
268519 103599742 1 ON5C24H33 AB5C24D33 24.31 2.73 -8.62 -0.7 0
268520 103599743 1 O2N3C25H27 A2B3C25D27 -18.11 6.74 -8.94 -0.1 0
268521 103599757 2 N2O2H11C12 A2B2C11D12 1.11 6.72 -8.76 -0.87 0
268522 103599758 1 ClSO2N3H18C23 ABC2D3E18F23 47.5 3.75 -8.33 -1.37 0
268523 103599768 1 O2N6C23H24 A2B6C23D24 48.05 3.05 -8.63 -0.9 0
268524 103599783 1 BrSO2N3C18H18 ABC2D3E18F18 5.66 5.34 -9.18 -0.9 0
268525 103599784 1 OSBr2N3H11C15 ABC2D3E11F15 71.56 3.39 -9.16 -1.15 0
268526 103599785 1 BrOS2N3C16H18 ABC2D3E16F18 37.92 1.55 -8.67 -0.99 0
268527 103599793 1 BrSN3O3C15H20 ABC3D3E15F20 -77.13 2.14 -8.82 -1.2 0
268528 103599794 1 BrClSO2N3H11C16 ABCD2E3F11G16 56.02 3.58 -9.48 -1.2 0
268529 103599798 1 ClSN3O3H18C19 ABC3D3E18F19 -50.04 7.22 -8.94 -1.34 0
268530 103599808 1 OCl2N5H15C20 AB2C5D15E20 86.0 3.98 -9.12 -1.14 0
268531 103599811 1 BrOSN4C19H23 ABCD4E19F23 36.18 2.5 -8.38 -1.17 0
268532 103599827 1 ClO2N6C22H31 AB2C6D22E31 -35.72 5.38 -8.63 -0.46 0
268533 103599828 1 ClO2N6C22H31 AB2C6D22E31 -33.73 4.38 -8.64 -0.43 0
268534 103599830 1 O2N5C26H31 A2B5C26D31 -9.17 5.69 -8.39 -0.4 0
268535 103599842 1 ClON5C22H22 ABC5D22E22 48.48 6.06 -8.78 -1.24 0
268536 103599843 1 ClN4O5H13C18 AB4C5D13E18 -36.79 9.93 -9.42 -1.61 0
268537 103599844 1 ClON5C22H22 ABC5D22E22 50.53 4.25 -8.87 -1.04 0
268538 103599846 1 ClO2N3C20H26 AB2C3D20E26 -53.94 4.32 -8.83 -0.46 0
268539 103599850 1 ClO2N3C20H26 AB2C3D20E26 -52.33 4.76 -8.85 -0.49 0
268540 103599852 2 ON2H12C13 AB2C12D13 45.12 7.64 -8.86 -0.96 0
268541 103599855 2 NOC8H10 ABC8D10 -79.17 3.26 -9.61 -0.05 0
268542 103599858 1 ClO2C18H19 AB2C18D19 -50.25 2.45 -8.74 -0.74 0
268543 103599865 1 NO2C16H25 AB2C16D25 -90.35 4.89 -8.48 0.48 0
268544 103599869 1 NO2C17H27 AB2C17D27 -103.93 3.54 -8.88 0.11 0
268545 103599870 1 NO2C15H21 AB2C15D21 -62.0 4.05 -8.92 0.06 0
268546 103599871 1 NO2C16H25 AB2C16D25 -99.15 3.53 -8.91 0.08 0
268547 103599875 1 NO2C18H27 AB2C18D27 -104.0 3.36 -8.82 0.15 0
268548 103599879 1 NO2C16H23 AB2C16D23 -70.61 3.36 -8.92 0.07 0
268549 103599881 1 ClO2C18H19 AB2C18D19 -48.17 3.55 -8.72 -0.96 0