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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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150633 53790326 1 S2N5O7C32H45 A2B5C7D32E45 -324.98 9.22 -8.94 -0.15 0
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150634 53790327 1 O7C39H54 A7B39C54 -306.65 5.21 -8.68 -0.74 0
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150635 53790328 1 Si2O4S7C16H38 A2B4C7D16E38 -355.17 4.16 -8.55 -2.01 0
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150636 53790329 1 N2S2O6C19H26 A2B2C6D19E26 -192.68 3.67 -9.42 -1.08 0
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150637 53790330 1 Cl2N3O4H15C21 A2B3C4D15E21 -116.45 9.95 -9.48 -1.25 0
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150638 53790331 1 Br2O3H14C16 A2B3C14D16 -80.05 2.2 -9.7 -1.25 0
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150639 53790332 1 F3C23H29 A3B23C29 -120.08 4.95 -9.58 -0.74 0
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150640 53790333 1 FSN3O5C27H32 ABC3D5E27F32 -189.43 7.67 -8.52 -1.08 0
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150641 53790335 1 FO2N4H29C32 AB2C4D29E32 46.88 7.03 -8.38 -0.57 0
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150642 53790336 2 SN3O3C10H10 AB3C3D10E10 -134.85 4.45 -9.3 -1.38 0
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150643 53790337 1 NOC23H39 ABC23D39 -91.32 2.17 -8.66 2.27 0
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150644 53790338 1 NOC23H39 ABC23D39 -91.22 2.15 -8.72 2.24 0
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150645 53790339 1 O3C20H34 A3B20C34 -153.3 5.0 -9.54 -0.91 0
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150646 53790340 1 O3C20H34 A3B20C34 -153.0 7.56 -9.73 -0.85 0
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150647 53790341 1 O5C29H44 A5B29C44 -244.36 4.4 -8.55 0.14 0
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150648 53790342 1 O5C29H44 A5B29C44 -243.96 2.96 -8.96 0.24 0
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150649 53790343 2 O2C5H8 A2B5C8 -179.06 4.28 -11.31 -1.46 0
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150650 53790344 1 SN2O2H8C12 AB2C2D8E12 -0.3 10.82 -8.01 -2.1 0
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150651 53790345 1 BrO4C21H35 AB4C21D35 -216.39 3.92 -9.97 -0.35 0
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150652 53790346 1 N2O3C39H78 A2B3C39D78 -298.43 2.79 -9.75 0.55 0
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150653 53790347 1 PO4C18H33 AB4C18D33 -248.31 6.11 -9.14 0.83 0
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150654 53790348 1 BrClO4H14C17 ABC4D14E17 -102.64 2.18 -9.13 -0.77 0
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150655 53790349 2 O2F4H4C5 A2B4C4D5 -561.91 5.25 -11.71 -1.89 0
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150656 53790350 1 N2O3H54C59 A2B3C54D59 54.93 2.16 -7.94 -0.6 0
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150657 53790351 1 N3O11C40H67 A3B11C40D67 -447.33 4.63 -8.53 -0.36 0
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150658 53790352 1 SF2O4N5C23H31 AB2C4D5E23F31 -234.55 3.74 -8.82 -0.6 0
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150659 53790353 1 ClSN5H20C23 ABC5D20E23 114.77 2.64 -8.23 -0.63 0
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150660 53790354 1 O3C40H58 A3B40C58 -168.52 2.84 -8.39 -0.49 0
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150661 53790355 1 FNO3H14C17 ABC3D14E17 -126.16 5.43 -8.72 -0.47 0
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150662 53790356 1 SN3O3H15C17 AB3C3D15E17 -28.8 4.13 -8.64 -0.92 1
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150663 53790357 1 N3O3H12C13 A3B3C12D13 -52.68 1.28 0.0 0.0 0
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150664 53790358 1 NSO4C13H15 ABC4D13E15 -136.38 6.77 -8.64 -0.28 0
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150665 53790359 1 NO4C8H11 AB4C8D11 -114.38 3.46 -9.56 -0.79 1
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150666 53790360 1 N3O5C18H20 A3B5C18D20 -89.55 7.01 0.0 0.0 0
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150667 53790361 1 FN2O4H21C23 AB2C4D21E23 -111.63 0.89 -8.74 -0.84 1
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150668 53790362 1 N3O4H16C18 A3B4C16D18 -44.15 2.07 0.0 0.0 0
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150669 53790363 1 ON2C8H20 AB2C8D20 -65.89 4.04 -8.8 2.74 0
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150670 53790364 1 C29H40 A29B40 60.46 0.25 -8.61 -0.38 0
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150671 53790365 1 IO4C13H13 AB4C13D13 -109.55 1.71 -9.81 -1.21 0
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150672 53790366 1 O3C20H30 A3B20C30 -149.86 4.54 -9.18 -0.1 0
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150673 53790367 1 NOC20H41 ABC20D41 -147.32 4.32 -9.2 1.36 0
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150674 53790368 1 NCl2O5H17C24 AB2C5D17E24 -113.27 6.76 -8.48 -0.92 0
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150675 53790369 1 ON5C10H27 AB5C10D27 -51.49 1.45 -9.03 2.1 0
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150676 53790370 1 O2C23H28 A2B23C28 -17.15 2.19 -9.09 0.25 0
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150677 53790371 1 NO4C25H39 AB4C25D39 -117.99 5.73 -9.67 -0.92 0
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150678 53790372 1 NO2C17H19 AB2C17D19 -43.76 3.37 -9.29 0.16 1
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150679 53790373 1 NPSiO9C37H47 ABCD9E37F47 -297.19 4.29 0.0 0.0 0
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150680 53790374 1 ON4C10H18 AB4C10D18 34.89 4.26 -9.45 -0.93 0
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150681 53790375 1 O4N5C24H39 A4B5C24D39 -182.67 3.06 -9.29 -0.05 1
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150682 53790376 1 NO2C15H26 AB2C15D26 -41.29 4.55 0.0 0.0 0