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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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381612 134972401 1 SiO7C40H42 AB7C40D42 -264.69 1.39 -8.92 -1.79 0
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381613 134972402 1 SiO6C33H42 AB6C33D42 -252.8 3.77 -8.88 -0.95 0
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381615 134972404 1 CuC2H6 AB2C6 86.86 1.59 0.0 0.0 0
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381616 134972405 1 SC8H14 AB8C14 12.1 1.74 -8.56 0.77 0
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381617 134972408 1 N2O2C21H22 A2B2C21D22 -13.0 2.33 -8.73 -1.63 0
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381618 134972410 1 N2O3C19H20 A2B3C19D20 -52.76 4.83 -9.43 -0.25 0
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381619 134972411 1 N2O2H14C17 A2B2C14D17 -25.31 4.87 -9.39 -0.72 1
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381620 134972412 1 PO5C11H18 AB5C11D18 -200.52 3.2 0.0 0.0 0
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381621 134972413 1 N2F3H7C11 A2B3C7D11 -89.95 3.7 -9.22 -1.18 0
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381622 134972414 1 INO2H12C18 ABC2D12E18 81.9 4.62 -9.3 -1.6 0
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381623 134972415 1 NOSiS2C19H31 ABCD2E19F31 -88.87 1.11 -8.72 -0.75 0
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381624 134972416 1 SiO2C19H30 AB2C19D30 -98.71 3.07 -8.68 0.43 0
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381625 134972417 1 BrO2C11H11 AB2C11D11 -56.75 4.43 -8.42 -0.74 0
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381626 134972418 1 InC4H5 AB4C5 73.63 0.39 -8.3 1.52 0
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381627 134972419 1 O3H14C18 A3B14C18 4.48 3.48 -8.47 -0.67 0
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381628 134972420 1 N3O6C9H17 A3B6C9D17 -197.93 5.32 -9.91 -0.01 0
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381630 134972423 1 N5O8C26H47 A5B8C26D47 -438.58 2.68 -9.24 0.59 0
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381631 134972424 1 O10H26C31 A10B26C31 -324.01 5.91 -9.06 -1.83 0
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381634 134972430 1 SO9C16H24 AB9C16D24 -423.67 0.55 -8.95 0.26 0
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381636 134972432 1 SO17C28H40 AB17C28D40 -783.34 5.78 -8.99 0.21 0
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381639 134972435 2 NO2C8H13 AB2C8D13 -162.26 1.38 -9.33 -0.29 0
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381640 134972436 2 O2C9H13 A2B9C13 -195.34 1.89 -9.31 0.36 1
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381641 134972437 1 PRuCl2F5H11C18 ABC2D5E11F18 -18.27 5.73 0.0 0.0 0
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381642 134972438 1 SiO3C13H28 AB3C13D28 -224.64 2.89 -8.86 0.19 0
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381643 134972439 1 NO2C17H25 AB2C17D25 -98.09 2.95 -9.04 0.34 0
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381644 134972441 1 N2O3C24H26 A2B3C24D26 -46.2 4.06 -8.35 -1.53 0
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381645 134972442 2 O4C5H9 A4B5C9 -349.42 3.21 -10.02 -0.69 0
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381646 134972443 1 IO2C9H9 AB2C9D9 -41.78 5.04 -9.55 -1.32 0
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381647 134972444 1 NO5H21C22 AB5C21D22 -157.67 4.33 -8.63 -0.87 0
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381648 134972445 1 NO5C26H29 AB5C26D29 -94.67 0.9 -9.4 0.05 0
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381649 134972446 1 INSiO4C42H46 ABCD4E42F46 -27.13 1.41 -8.0 -0.86 0
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381650 134972447 1 NO4C8H13 AB4C8D13 -135.73 3.61 -9.85 -0.27 0
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381651 134972448 1 NSO5C19H31 ABC5D19E31 -252.18 5.34 -9.82 -0.05 0
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381652 134972449 1 O3H18C23 A3B18C23 -18.99 4.88 -9.09 -0.85 0
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381653 134972451 1 SO2N3C14H17 AB2C3D14E17 -1.43 7.17 -8.08 -0.53 0
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381654 134972452 1 NO3C15H17 AB3C15D17 12.76 7.78 -9.58 -1.24 0
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381655 134972453 1 NOF4H7C9 ABC4D7E9 -194.67 3.98 -9.09 -0.91 0
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381656 134972454 1 SO17C28H40 AB17C28D40 -777.75 4.0 -8.77 0.39 0
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381658 134972456 1 O26C39H54 A26B39C54 -1175.84 2.94 -10.12 0.33 0
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381659 134972457 1 O18C27H38 A18B27C38 -816.56 1.12 -10.52 0.38 0
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381660 134972458 1 NO18C39H43 AB18C39D43 -736.66 3.9 -9.7 -1.31 0
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381661 134972459 1 O16C25H36 A16B25C36 -715.96 4.48 -9.8 0.15 0
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381662 134972460 1 O18C27H38 A18B27C38 -812.27 4.87 -9.91 0.32 0
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381663 134972461 1 BrO4H17C22 AB4C17D22 -84.38 1.38 -9.64 -1.02 0
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381664 134972462 1 Br2N2O5C22H22 A2B2C5D22E22 -129.33 3.89 -9.58 -1.27 0
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381665 134972463 1 NC9H15 AB9C15 18.18 2.2 -8.14 1.04 0
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381667 134972465 1 NSSiC16H17 ABCD16E17 81.52 3.24 -8.62 -0.98 2
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381668 134972466 1 AuPH16C18 ABC16D18 135.45 1.52 -8.59 0.1 0
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381669 134972467 2 C4H5 A4B5 51.43 0.72 -9.09 0.34 0
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381670 134972468 1 NO3C30H41 AB3C30D41 -37.95 6.52 -8.78 -1.16 0