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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231370 87573569 1 ClO3N8C22H25 AB3C8D22E25 -32.98 12.17 -9.23 -0.94 1
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231371 87573571 1 ClFSO2N3H12C18 ABCD2E3F12G18 -41.03 2.32 0.0 0.0 0
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231372 87573572 1 ClFSO2N3H13C18 ABCD2E3F13G18 -39.02 2.75 -9.02 -0.81 0
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231373 87573573 1 O6N11C53H63 A6B11C53D63 -139.9 12.32 -8.65 -0.81 0
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231374 87573575 1 ClO2N9C27H36 AB2C9D27E36 -9.45 11.47 -9.29 -1.01 0
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231375 87573577 1 SN2O2C14H14 AB2C2D14E14 -30.45 5.62 -8.1 -1.26 0
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231376 87573580 1 ON2Cl4C16H16 AB2C4D16E16 -19.82 4.17 -9.21 -1.02 0
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231377 87573582 1 ClN2H19C24 AB2C19D24 101.09 5.68 -9.18 -1.28 0
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231378 87573585 1 F4O4C11H16 A4B4C11D16 -375.26 7.12 -10.45 -0.19 0
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231379 87573587 1 NO4C16H23 AB4C16D23 -131.72 2.19 -9.76 -0.83 0
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231380 87573588 1 O6N9C51H65 A6B9C51D65 -194.44 7.54 -8.96 -0.6 0
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231381 87573592 1 NSC2H2F3O3 ABC2D2E3F3 -241.16 3.1 -12.65 -1.52 0
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231382 87573593 1 BrN2O4H25C26 AB2C4D25E26 -26.66 4.77 -9.49 -0.98 0
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231383 87573594 1 BrN3O3C17H24 AB3C3D17E24 -102.6 7.1 -8.91 -0.42 0
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231384 87573596 1 NSF3O4C11H18 ABC3D4E11F18 -310.7 15.34 -7.66 -1.26 1
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231385 87573598 1 PN4C28H60 AB4C28D60 -47.24 9.87 0.0 0.0 1
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231386 87573599 1 PN3C28H57 AB3C28D57 -25.99 27.54 0.0 0.0 0
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231387 87573601 1 NSO5C12H19 ABC5D12E19 -212.27 7.62 -9.8 -0.55 0
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231388 87573604 1 OCl2N5C21H29 AB2C5D21E29 -28.25 4.02 -8.69 -0.07 0
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231389 87573606 1 O4N5F6C12H17 A4B5C6D12E17 -455.23 3.46 -9.34 -1.08 0
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231390 87573608 1 BrSO2N8C19H23 ABC2D8E19F23 20.91 3.87 -8.54 -0.58 0
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231391 87573609 1 SF3C10H13 AB3C10D13 -141.39 4.47 -9.51 -0.38 0
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231392 87573610 2 O5H11C13 A5B11C13 -302.85 10.49 -10.64 -1.62 0
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231393 87573611 1 NSi2C19H38 AB2C19D38 4.15 3.02 0.0 0.0 0
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231394 87573616 1 SiO4C20H35 AB4C20D35 -179.92 5.01 0.0 0.0 0