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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231607 87574300 1 ClO2N5C21H22 AB2C5D21E22 14.94 3.03 -8.32 -0.25 0
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231608 87574301 2 NaSO5C14H27 ABC5D14E27 -463.05 5.61 -4.15 -0.9 0
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231609 87574303 1 NSO2H13C14 ABC2D13E14 -28.29 3.69 -8.38 -1.19 0
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231610 87574304 1 O3F4N4H14C17 A3B4C4D14E17 -248.46 3.56 -9.21 -1.24 0
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231611 87574305 1 N2O2C23H40 A2B2C23D40 -78.22 4.63 -9.2 0.87 0
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231612 87574306 1 ClSF2O2H7C9 ABC2D2E7F9 -141.91 4.3 -10.55 -1.22 0
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231613 87574307 1 Cl2O5N10C61H66 A2B5C10D61E66 -36.32 12.65 -8.64 -1.31 0
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231614 87574308 1 SiO4C22H26 AB4C22D26 -177.05 5.35 -9.32 -0.35 0
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231615 87574310 1 SN2O2C14H14 AB2C2D14E14 -31.61 5.24 -8.28 -1.12 0
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231616 87574313 1 FNSO4H14C18 ABCD4E14F18 -34.29 6.64 -9.14 -1.35 0
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231617 87574314 1 I6N6O13C31H36 A6B6C13D31E36 -390.03 2.53 -9.22 -2.32 0
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231618 87574315 1 ClO2N10C28H37 AB2C10D28E37 13.7 17.84 -9.2 -0.93 0
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231619 87574316 1 F3O4C10H15 A3B4C10D15 -328.06 6.09 -10.43 -0.58 0
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231621 87574320 2 N4C11H16 A4B11C16 140.19 1.89 -9.54 -0.55 0
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231622 87574322 1 FSCl2O2H7C9 ABC2D2E7F9 -102.5 4.36 -10.15 -1.15 0
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231623 87574323 1 ClOSF3N4H12C21 ABCD3E4F12G21 42.39 6.84 -9.15 -2.16 0
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231625 87574326 1 ON3C11H17 AB3C11D17 -32.53 4.2 -8.78 -0.01 0
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231626 87574329 1 N2F6C9H10 A2B6C9D10 -277.95 3.23 -9.68 -0.32 0
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231627 87574330 1 SCl2N2F4O4H6C18 AB2C2D4E4F6G18 -249.89 3.01 -9.58 -1.91 0
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231628 87574331 1 ClON3C25H30 ABC3D25E30 12.34 4.65 -8.42 -0.43 0
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231629 87574337 1 SO3N4C5H6 AB3C4D5E6 -22.63 5.59 -9.81 -1.18 0
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231630 87574341 1 SeO2N5C19H19 AB2C5D19E19 88.51 4.22 -8.8 -0.96 0
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231631 87574342 2 PO2H18C20 AB2C18D20 -63.45 7.76 -9.02 -0.28 0
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231632 87574343 1 SiO4C17H24 AB4C17D24 -211.84 3.79 -9.28 -0.37 0
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231633 87574345 1 BrClO2N5C12H19 ABC2D5E12F19 -90.86 3.91 -9.05 -0.36 0
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231634 87574346 1 NOSC12H25 ABCD12E25 -57.99 2.81 -8.51 0.49 0
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231635 87574347 1 NOSC12H25 ABCD12E25 -53.13 3.49 -8.46 0.51 0
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231636 87574348 1 ClOSN6C17H19 ABCD6E17F19 37.92 0.73 -9.15 -1.02 0
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231637 87574349 1 OSN7C25H27 ABC7D25E27 108.47 2.37 -8.42 -1.02 0
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231638 87574351 2 PO3C15H16 AB3C15D16 -206.23 3.87 -8.26 -0.25 0
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231639 87574353 1 N2O5C25H46 A2B5C25D46 -305.66 3.64 -9.67 0.62 0
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231640 87574358 1 N4O5C21H24 A4B5C21D24 -145.41 11.38 -8.31 -1.09 0
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231641 87574359 1 O3C17H30 A3B17C30 -149.44 4.26 -9.88 0.71 1
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231642 87574363 1 O3N6C19H25 A3B6C19D25 -5.33 4.43 0.0 0.0 0
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231643 87574364 1 SN3C12H15 AB3C12D15 25.06 1.88 -8.59 -0.37 0
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231644 87574368 1 SO2N6C29H30 AB2C6D29E30 36.64 3.25 -8.88 -1.01 0
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231645 87574370 1 ClNOC5H8 ABCD5E8 -49.84 2.04 -10.2 0.61 0
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231646 87574373 1 Cl2O4N6H16C21 A2B4C6D16E21 -10.85 5.17 -8.99 -1.57 0
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231647 87574374 1 SO3N4C16H16 AB3C4D16E16 -19.46 8.47 -8.41 -2.08 0
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231648 87574375 1 OSN6C23H24 ABC6D23E24 84.12 3.93 -8.48 -1.0 0
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231649 87574377 1 S2F3N3O4H14C16 A2B3C3D4E14F16 -201.02 5.16 -8.21 -0.58 0
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231650 87574380 1 OSCl2N9H19C24 ABC2D9E19F24 100.95 7.26 -8.25 -1.22 0
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231651 87574382 1 SnS6C9H17 AB6C9D17 13.2 4.34 0.0 0.0 0
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231652 87574385 1 S2N3O3F4H19C25 A2B3C3D4E19F25 -178.24 3.84 -9.01 -1.2 0
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231655 87574393 1 NSO3H7C10 ABC3D7E10 -36.01 3.85 -9.92 -1.42 -7
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231656 87574397 1 WO6C7H9 AB6C7D9 -72.0 4.29 0.0 0.0 1
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231657 87574400 1 N2O2C5H15 A2B2C5D15 -29.5 7.94 0.0 0.0 0
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231658 87574401 1 ClN3H8C13 AB3C8D13 96.28 4.19 -9.53 -1.44 0
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231659 87574404 1 SiO4C30H58 AB4C30D58 -328.98 1.96 -9.52 -0.53 0
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231660 87574405 1 SiO4C10H18 AB4C10D18 -232.7 4.99 -9.82 -0.35 0