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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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161384 57391509 1 O2N10C15H16 A2B10C15D16 101.26 4.51 -9.93 -2.2 0
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161386 57391516 1 ClN2O2H19C21 AB2C2D19E21 -14.39 3.6 -9.04 -0.82 0
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161388 57391518 1 ClN3O6C26H26 AB3C6D26E26 -190.5 6.97 -9.03 -0.82 0
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161389 57391521 1 ClISN3O4C21H25 ABCD3E4F21G25 -149.62 7.12 -8.63 -1.21 0
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161390 57391522 1 FISN3O4C19H21 ABCD3E4F19G21 -133.19 2.11 -8.86 -1.38 0
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161391 57391523 1 BrClO2N4H20C26 ABC2D4E20F26 53.86 8.12 -8.25 -0.77 0
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161393 57391526 1 SiO7C40H52 AB7C40D52 -331.34 6.73 -9.06 -0.49 0
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161394 57391528 1 O5C39H44 A5B39C44 -145.78 5.24 -9.44 -0.53 0
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161396 57391532 1 O5H18C19 A5B18C19 -170.04 2.99 -8.59 -0.09 0
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161397 57391535 1 OF3N6H15C16 AB3C6D15E16 -87.42 4.47 -9.46 -0.78 0
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161399 57391542 1 FON5H16C22 ABC5D16E22 63.07 4.66 -8.6 -1.39 0
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161400 57391548 1 O7C17H24 A7B17C24 -298.68 2.56 -8.59 -0.13 0
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161401 57391552 1 ClN3O3C30H34 AB3C3D30E34 -73.95 7.76 -8.88 0.0 0
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161402 57391558 1 F2Cl3O4N5C33H36 A2B3C4D5E33F36 -200.44 5.61 -9.23 -0.42 0
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161404 57391564 1 Cl2N5O5C34H37 A2B5C5D34E37 -147.74 5.71 -8.82 -0.37 0
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161405 57391573 1 SO2N4C18H26 AB2C4D18E26 -54.63 7.16 -8.32 -0.1 0
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161406 57391574 1 N2F3C25H27 A2B3C25D27 -125.74 6.47 -8.64 -0.34 0
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161407 57391576 2 ClN2H5C6 AB2C5D6 77.46 3.8 -9.29 -1.23 0
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161408 57391579 1 Cl2N2S2O3C17H24 A2B2C2D3E17F24 -131.58 3.55 -9.51 -1.36 0
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161409 57391581 1 O2N3H21C24 A2B3C21D24 49.6 7.07 -9.57 -0.96 1
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161410 57391592 1 SN2H27C30 AB2C27D30 123.66 3.94 0.0 0.0 1
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161411 57391593 1 SN2O2H27C31 AB2C2D27E31 50.46 4.26 0.0 0.0 0
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161412 57391594 1 NO2C20H29 AB2C20D29 -94.64 2.06 -8.64 0.41 0
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161414 57391599 1 PSN17O24C69H110 ABC17D24E69F110 -1198.46 7.86 -8.94 -0.45 0
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161415 57391602 1 N2F3O3C17H19 A2B3C3D17E19 -246.02 9.78 -9.73 -1.21 0