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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219390 85148351 1 SN2O2H26C30 AB2C2D26E30 48.97 6.11 -8.41 -0.36 0
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219391 85148352 1 OSN8C24H34 ABC8D24E34 45.05 3.86 -8.49 -0.35 -1
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219392 85148354 1 NS3O4C23H28 AB3C4D23E28 -76.99 9.71 0.0 0.0 0
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219393 85148355 1 NS3O4C23H29 AB3C4D23E29 -103.9 7.69 -8.16 -0.5 0
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219394 85148356 1 N2C33H54 A2B33C54 -39.43 1.52 -8.5 0.5 0
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219395 85148357 1 ClF4N4O4C19H21 AB4C4D4E19F21 -360.28 5.11 -9.06 -0.7 0
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219396 85148358 1 ClFSO2N4H16C24 ABCD2E4F16G24 26.16 2.34 -9.36 -1.0 0
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219397 85148359 1 INOS2H18C20 ABCD2E18F20 56.9 2.14 -8.9 -1.42 0
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219398 85148360 1 F3N7C25H28 A3B7C25D28 -43.48 7.37 -8.13 -0.67 0
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219399 85148361 1 SN3O5C25H25 AB3C5D25E25 -121.66 6.85 -8.36 -0.39 0
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219400 85148362 1 S3N5O5H17C18 A3B5C5D17E18 -55.15 4.26 -9.2 -1.0 0
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219401 85148363 1 NSO5C27H29 ABC5D27E29 -139.1 3.98 -8.47 -0.77 0
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219402 85148364 1 BrSi2O4C20H39 AB2C4D20E39 -313.81 5.57 -8.9 -0.45 0
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219403 85148365 1 ClSO3N7H14C21 ABC3D7E14F21 112.65 10.22 -8.49 -1.84 1
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219404 85148366 1 ClSO3N7H15C21 ABC3D7E15F21 105.23 8.28 0.0 0.0 0
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219405 85148367 1 O13H20C21 A13B20C21 -478.24 7.36 -8.92 -1.22 0
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219406 85148368 2 NSO4C10H10 ABC4D10E10 -206.42 5.41 -9.2 -1.84 0
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219407 85148369 1 SN4O7C21H28 AB4C7D21E28 -275.12 6.1 -8.92 -0.9 0
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219408 85148370 1 SN4O5C24H24 AB4C5D24E24 -82.01 10.88 -8.69 -1.7 0
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219409 85148371 1 O11C22H40 A11B22C40 -512.72 5.51 -10.09 0.74 0
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219410 85148372 1 N2O5C28H36 A2B5C28D36 -188.39 3.81 -8.58 -0.13 0
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219411 85148373 1 N2O5C28H38 A2B5C28D38 -183.89 4.13 -8.58 -0.76 0
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219412 85148374 2 ON2C15H16 AB2C15D16 7.6 0.92 -8.91 -0.33 0
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219413 85148375 1 O7C27H44 A7B27C44 -356.51 1.48 -9.93 0.28 0
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219414 85148376 1 O7C27H44 A7B27C44 -319.58 3.64 -8.43 0.29 0