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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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176602 76071978 1 ClFN6O9C58H82 ABC6D9E58F82 -490.04 6.99 -9.2 -1.18 0
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176603 76072294 1 SF2O2N4C22H24 AB2C2D4E22F24 -112.87 1.77 -8.59 -0.68 0
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176604 76072295 1 F2O2N4C25H30 A2B2C4D25E30 -120.97 2.61 -8.43 -0.52 0
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176605 76072296 1 O2F3N4C24H27 A2B3C4D24E27 -161.08 4.8 -8.67 -0.68 0
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176606 76072441 1 O2N3C24H29 A2B3C24D29 -13.88 5.54 -8.74 0.05 0
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176607 76072570 1 ClSN2O4H21C24 ABC2D4E21F24 -80.26 3.7 -8.88 -1.15 0
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176608 76072622 1 ClN2O3H17C21 AB2C3D17E21 -27.08 1.93 -8.66 -1.05 0
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176609 76073030 1 BrFON6H16C17 ABCD6E16F17 8.24 4.07 -9.26 -1.38 0
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176610 76073489 1 ClSN2O3H15C20 ABC2D3E15F20 -44.48 6.92 -8.91 -1.34 0
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176611 76073813 1 C19H20 A19B20 73.3 0.16 -8.63 -0.07 1
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176612 76073854 1 NPO8C44H81 ABC8D44E81 -433.07 16.17 0.0 0.0 0
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176613 76074154 1 N5O7C38H55 A5B7C38D55 -303.7 5.06 -8.76 -1.38 0
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176614 76074155 1 FN3O6C31H32 AB3C6D31E32 -232.81 6.37 -8.97 -1.34 0
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176615 76074156 1 O7C34H56 A7B34C56 -352.58 2.89 -9.49 0.31 0
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176616 76074513 1 O2C25H42 A2B25C42 -102.93 2.11 -9.42 0.59 0
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176617 76074561 2 C10H17 A10B17 -23.5 0.92 -9.08 1.42 0
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176618 76074620 1 N2O4C17H32 A2B4C17D32 -240.91 3.6 -9.9 0.32 0
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176619 76074801 1 S2N3O4C18H21 A2B3C4D18E21 -122.9 6.75 -8.77 -0.5 2
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176620 76075208 1 S2O7N8C23H30 A2B7C8D23E30 -36.5 30.73 -6.23 -3.61 0
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176621 76075209 1 NOSCl2C19H19 ABCD2E19F19 -17.19 3.32 -9.12 -0.93 0
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176622 76075210 1 SN4O16C67H120 AB4C16D67E120 -940.72 7.05 -9.15 -0.71 0
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176623 76075409 1 N3O5H19C21 A3B5C19D21 -59.59 3.16 -8.67 -0.88 0
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176624 76075410 1 O5C37H52 A5B37C52 -220.88 3.78 -8.19 -0.02 0
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176625 76075460 1 ClN2O5H19C23 AB2C5D19E23 -31.21 4.71 -8.52 -1.03 0
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176626 76075461 1 FS2N3O4C21H28 AB2C3D4E21F28 -187.12 4.77 -9.62 -0.7 0
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176627 76075544 1 FN3O4C21H22 AB3C4D21E22 -160.26 9.97 -9.6 -1.28 0
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176628 76075545 1 ON4C12H16 AB4C12D16 38.1 7.74 -8.11 -0.32 0
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176629 76075881 1 O2N3C10H17 A2B3C10D17 -18.95 4.45 -9.79 -0.12 0
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176630 76075903 1 SN7O7C36H45 AB7C7D36E45 -216.75 5.53 -8.89 -1.43 0
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176631 76075910 1 N3O8C41H51 A3B8C41D51 -285.22 2.9 -8.54 -0.23 0
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176632 76075911 2 O2C13H18 A2B13C18 -143.07 4.39 -9.17 1.22 0
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176633 76075912 1 ON7C27H31 AB7C27D31 104.42 10.12 -8.32 -0.91 0
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176634 76075913 1 NSO3C9H9 ABC3D9E9 -68.77 5.93 -9.68 -1.05 0
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176635 76076112 1 NO6C12H21 AB6C12D21 -282.49 3.84 -9.78 -0.47 0
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176636 76076113 1 BrNSO3C16H24 ABCD3E16F24 -129.74 5.14 -9.16 -0.18 0
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176637 76076114 1 NO3C26H27 AB3C26D27 -69.44 5.56 -8.55 -0.31 0
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176638 76076257 1 SN4O4C14H18 AB4C4D14E18 -92.03 7.16 -8.88 -1.76 0
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176639 76076258 1 ClFN2O7C33H36 ABC2D7E33F36 -271.2 7.06 -8.71 -0.39 1
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176640 76076259 1 O3N8C27H29 A3B8C27D29 42.75 6.34 0.0 0.0 0
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176641 76077024 2 O4C24H25 A4B24C25 -187.35 4.3 -8.73 -0.12 0
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176642 76078674 1 N5O7C43H55 A5B7C43D55 -276.63 11.86 -9.17 -0.79 0
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176643 76078675 1 S2N4O14C35H38 A2B4C14D35E38 -491.48 5.15 -9.27 -0.62 0
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176644 76078942 1 SO4C6H12 AB4C6D12 -183.72 2.84 -9.2 -0.34 0
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176645 76078943 1 ClN3O4C32H38 AB3C4D32E38 -99.33 3.28 -8.83 -0.38 0
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176646 76079118 2 N2O2C6H7 A2B2C6D7 -69.95 9.7 -9.57 -1.3 0
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176647 76079391 1 BrN2O2C17H17 AB2C2D17E17 -30.43 2.64 -9.62 -1.18 0
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176648 76079392 1 ClN2O2C17H17 AB2C2D17E17 -10.69 1.98 -8.45 -0.45 1
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176649 76079393 1 O2S2C6N6H9 A2B2C6D6E9 24.39 7.8 0.0 0.0 0
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176650 76079394 1 NSO2C10H19 ABC2D10E19 -127.42 3.8 -9.07 0.34 0
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176651 76079395 1 S4O5N7C20H21 A4B5C7D20E21 -29.95 5.42 -8.78 -1.28 0