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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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84299 49865621 1 N2O3C24H32 A2B3C24D32 -73.07 5.61 -8.54 -0.03 0
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84300 49865622 1 IN2O3C24H31 AB2C3D24E31 -57.14 4.15 -8.39 -1.04 0
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84301 49865634 1 N2O7C21H24 A2B7C21D24 -184.43 5.37 -8.64 -1.47 0
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84302 49865645 1 O3N5C27H33 A3B5C27D33 -43.89 4.61 -8.72 -0.92 0
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84303 49865646 1 O3N4C24H28 A3B4C24D28 -49.45 2.26 -8.77 -0.92 0
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84304 49865668 1 ON4C24H30 AB4C24D30 31.63 3.38 -8.24 -0.34 0
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84305 49865669 1 NO3C22H29 AB3C22D29 -151.29 4.8 -8.53 0.0 0
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84306 49865672 1 N4O4C29H36 A4B4C29D36 -100.74 2.79 -8.7 -0.93 0
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84307 49865673 2 N2O2C14H17 A2B2C14D17 -102.76 5.21 -8.78 -0.95 0
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84308 49865674 1 N2O6H18C27 A2B6C18D27 -9.54 3.38 -9.45 -2.12 0
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84309 49865676 1 N2O6H18C27 A2B6C18D27 -11.58 3.16 -9.47 -1.81 0
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84310 49865679 1 ON6C30H32 AB6C30D32 70.49 2.44 -8.74 -1.16 0
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84311 49865680 1 ON5C30H35 AB5C30D35 28.68 5.81 -8.26 -0.2 0
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84312 49865684 1 BrPO4C32H34 ABC4D32E34 -71.43 23.37 -6.92 -1.52 0
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84313 49865685 1 BrPO4C42H54 ABC4D42E54 -121.14 13.27 -7.1 -1.76 0
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84314 49865690 1 NSO5C16H31 ABC5D16E31 -275.15 6.41 -10.21 0.21 0
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84315 49865691 1 O5C18H18 A5B18C18 -176.67 6.9 -9.77 -0.45 1
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84316 49865698 1 NPO4C29H53 ABC4D29E53 -287.75 2.25 0.0 0.0 0
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84317 49865712 2 NO2C17H19 AB2C17D19 -84.37 4.88 -8.46 0.1 0
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84318 49865722 1 N3O5C19H21 A3B5C19D21 -85.41 5.0 -8.41 -0.44 0
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84319 49865740 1 N2O3C31H32 A2B3C31D32 -16.77 4.23 -8.42 -0.41 0
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84320 49865751 1 N4O4H34C39 A4B4C34D39 -18.45 5.5 -8.75 -0.74 0
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84321 49865753 1 N3O5H31C32 A3B5C31D32 -115.92 6.41 -8.39 -0.51 0
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84322 49865765 1 Cl2N2O7C27H30 A2B2C7D27E30 -280.41 4.72 -9.13 -0.81 0
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84323 49865769 1 N3O4C19H21 A3B4C19D21 -47.37 3.84 -8.54 -0.24 0