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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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47641 10534557 2 Br2N2O4C37H72 A2B2C4D37E72 -351.61 259.03 -4.25 -3.97 4
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47643 10534559 2 BrCl2N2O8C35H43 AB2C2D8E35F43 -715.19 7.47 -8.98 -0.63 0
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47644 10534560 1 BrCl2N2O8C35H43 AB2C2D8E35F43 -343.62 1.92 -9.04 -0.98 0
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47645 10534561 1 BrCl2N2O8C35H43 AB2C2D8E35F43 -344.88 4.85 -8.93 -0.67 0
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47646 10534562 2 P2O8C44H53 A2B8C44D53 -638.2 8.72 -8.58 -0.3 0
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47649 10534578 1 N7O33C74H123 A7B33C74D123 -1512.08 9.56 -9.48 -1.19 0
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47650 10534579 1 N5O45C62H105 A5B45C62D105 -2058.17 9.65 -9.99 -0.23 0
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47651 10534580 2 O20C38H53 A20B38C53 -1694.99 7.65 -9.95 -0.55 0
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47652 10534581 1 N16O25C76H124 A16B25C76D124 -1134.99 7.24 -9.13 -1.0 0
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47653 10534583 1 N8O43C66H116 A8B43C66D116 -1970.03 10.03 -9.86 -0.08 0
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47655 10534587 6 NOSC17H23 ABCD17E23 13.41 8.7 -8.05 -0.38 0
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47656 10534588 1 IN7O33C74H124 AB7C33D74E124 -1487.86 10.51 -9.52 -1.5 0
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47657 10534589 1 O18N21C88H147 A18B21C88D147 -693.83 9.42 -8.11 -0.72 0
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47659 10534607 2 O5C71H109 A5B71C109 -602.33 4.64 -8.47 -1.13 0
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47660 10534672 1 NO2C6H9 AB2C6D9 -15.29 2.09 -9.58 0.61 0
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47661 10534673 1 NOC7H13 ABC7D13 -48.54 3.79 -10.86 1.26 0
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47662 10534676 1 O2C7H12 A2B7C12 -87.68 2.26 -9.56 0.93 0
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47664 10534680 1 NO2C6H11 AB2C6D11 -68.17 3.04 -10.08 0.58 0
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47665 10534681 1 NOC7H15 ABC7D15 -67.24 1.94 -9.42 2.39 0
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47667 10534684 1 O4C5H6 A4B5C6 -129.0 4.83 -10.87 -0.66 0
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47668 10534685 1 O3C6H10 A3B6C10 -133.66 2.01 -9.99 1.47 0
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47669 10534687 1 NO2C6H13 AB2C6D13 -101.08 1.48 -9.25 0.73 0
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47671 10534690 1 O2C7H14 A2B7C14 -105.11 3.15 -10.0 0.95 0
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47672 10534691 1 O2C7H14 A2B7C14 -96.92 2.54 -10.16 0.57 0
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47673 10534692 1 ON2C6H14 AB2C6D14 -11.1 2.29 -9.35 0.63 0
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47674 10534693 1 NO2C6H13 AB2C6D13 -101.95 1.96 -9.41 1.72 0
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47675 10534700 1 OSN2C4H8 ABC2D4E8 -14.65 2.89 -9.06 -0.17 0
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47676 10534705 1 SO3C4H6 AB3C4D6 -99.03 1.98 -9.82 -1.38 0
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47677 10534706 1 NOC8H9 ABC8D9 -6.76 3.82 -10.1 -0.93 0
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47678 10534715 1 NOC8H11 ABC8D11 -29.11 2.44 -8.52 1.27 0
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47679 10534721 2 N2C3H5 A2B3C5 54.27 4.58 -8.75 0.14 0
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47680 10534726 1 NF2O2C4H7 AB2C2D4E7 -197.41 4.54 -10.67 0.3 0
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47681 10534734 1 ClNH4C7 ABC4D7 45.88 2.43 -10.04 -1.06 0
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47682 10534739 2 OC4H6 AB4C6 -78.69 3.13 -10.17 -0.37 0
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47683 10534743 2 OC4H6 AB4C6 -60.29 1.59 -10.91 0.6 0
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47684 10534751 1 OC9H16 AB9C16 -74.07 2.99 -9.62 0.84 0
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47685 10534758 1 NOC8H15 ABC8D15 -60.83 3.23 -8.75 2.61 0
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47686 10534768 2 OC4H7 AB4C7 -69.83 3.35 -10.44 1.66 0
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47687 10534773 1 NO3C6H9 AB3C6D9 -112.61 6.27 -10.25 0.05 0
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47688 10534779 2 C2O3 A2B3 -184.47 0.01 -11.93 -2.64 0
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47689 10534782 2 OC4H8 AB4C8 -104.92 4.58 -9.93 0.58 0
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47690 10534784 2 OC4H8 AB4C8 -34.62 1.63 -9.72 0.37 0
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47691 10534792 1 NO2C7H15 AB2C7D15 -83.49 1.82 -9.57 1.42 0
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47692 10534795 1 PN2O2C4H7 AB2C2D4E7 -103.2 2.03 -9.85 0.14 0
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47693 10534797 1 N2O3C5H10 A2B3C5D10 -128.93 2.63 -9.86 0.47 0
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47694 10534805 2 O2C3H6 A2B3C6 -197.06 1.86 -10.32 1.58 0
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47695 10534807 1 ON2C8H8 AB2C8D8 28.63 6.14 -8.49 -1.02 0
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47696 10534811 1 OSN2C5H12 ABC2D5E12 -17.78 2.0 -8.8 0.28 0
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47697 10534821 1 N3C8H11 A3B8C11 83.69 3.33 -8.68 -0.38 0
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47698 10534827 1 NOC9H11 ABC9D11 14.2 1.1 -9.48 0.27 0