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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219440 85148670 1 ClSO2N6C25H29 ABC2D6E25F29 64.15 5.66 -8.91 -0.88 0
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219441 85148672 1 N3O8C26H27 A3B8C26D27 -243.82 2.79 -8.3 -0.92 0
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219442 85148673 1 PbO5C17H20 AB5C17D20 -176.87 6.03 -8.64 -1.86 0
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219443 85148674 1 S2N5O5H19C23 A2B5C5D19E23 -31.82 5.21 -8.88 -1.47 0
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219444 85148678 1 NO6C30H39 AB6C30D39 -249.03 2.43 -9.33 0.17 0
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219445 85148680 1 N3O4C29H55 A3B4C29D55 -286.46 5.99 -9.62 0.81 0
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219446 85148681 1 ClNO6C28H28 ABC6D28E28 -195.88 2.8 -8.79 -0.44 1
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219447 85148683 1 N3O5C27H28 A3B5C27D28 -67.5 5.05 0.0 0.0 0
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219448 85148684 1 O11H22C26 A11B22C26 -377.62 8.55 -9.07 -1.39 0
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219449 85148685 1 BrON5C26H30 ABC5D26E30 62.29 4.72 -8.72 -1.51 0
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219450 85148688 1 SN4O8C22H30 AB4C8D22E30 -325.97 9.09 -9.25 -1.27 0
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219451 85148689 1 N2O7C28H34 A2B7C28D34 -248.59 6.84 -9.14 -1.29 0
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219452 85148690 2 NO2C16H17 AB2C16D17 -100.63 6.43 -8.3 -0.19 0
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219453 85148691 2 NO2C16H17 AB2C16D17 -99.81 6.54 -8.25 -0.24 0
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219454 85148692 2 NO2C16H17 AB2C16D17 -97.92 7.16 -8.31 -0.12 1
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219455 85148696 1 PSN2O5C24H52 ABC2D5E24F52 -344.52 4.51 0.0 0.0 0
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219456 85148698 2 OC17H35 AB17C35 -263.33 2.74 -10.25 2.68 0
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219458 85148702 1 O2N5F6C22H31 A2B5C6D22E31 -417.02 8.33 -8.83 -0.82 0
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219459 85148703 1 FSN3O4C27H30 ABC3D4E27F30 -121.34 11.81 -8.19 -1.06 0
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219460 85148706 1 O5N9C22H41 A5B9C22D41 -212.84 4.36 -9.04 -0.15 0
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219461 85148707 1 SN3O5C27H33 AB3C5D27E33 -202.54 5.33 -9.35 -0.12 0
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219462 85148708 1 S4N5H13C25 A4B5C13D25 282.41 6.83 -9.21 -2.44 0
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219463 85148709 1 NSiO3C31H49 ABC3D31E49 -193.2 1.51 -8.84 0.17 0
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219464 85148711 1 ClN3O6C26H26 AB3C6D26E26 -207.26 2.84 -8.54 -1.02 0
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219465 85148712 1 PN2O8C25H27 AB2C8D25E27 -354.04 4.5 -8.42 -0.52 0