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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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15298 436556 1 NOC19H21 ABC19D21 -9.04 3.75 -8.73 -0.75 0
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15299 436557 1 NOC19H25 ABC19D25 -30.56 1.54 -8.63 -0.45 0
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15300 436558 1 ON2C20H24 AB2C20D24 2.81 1.84 -8.28 -0.74 0
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15301 436559 1 NOC21H21 ABC21D21 9.11 2.67 -8.82 -0.81 0
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15302 436578 1 ClN2H23C24 AB2C23D24 78.5 7.59 -7.88 -0.33 0
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15303 436615 2 NC12H25 AB12C25 78.94 0.82 -1.94 -0.48 2
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15304 436764 1 N3H5C6 A3B5C6 102.08 3.95 -10.44 -1.48 0
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15305 436798 1 SN4C10H12 AB4C10D12 66.56 3.71 -8.62 -0.54 0
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15306 436984 1 NC13H20 AB13C20 35.26 4.44 0.0 0.0 1
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15307 437013 1 OH6C13 AB6C13 521.11 2.25 -8.41 -1.32 -10
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15308 437024 2 NC7H11 AB7C11 12.25 2.03 -8.38 0.4 0
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15309 437154 2 NO2H15C18 AB2C15D18 -45.15 4.62 -9.2 -0.71 0
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15310 437502 1 N4C5H8 A4B5C8 55.84 3.46 -8.15 0.03 0
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15311 437736 2 N3O3H20C21 A3B3C20D21 -130.34 6.98 -8.3 -0.27 0
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15312 437848 1 NBr2Cl2C7H13 AB2C2D7E13 -33.66 2.42 -9.41 -0.84 0
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15313 437854 6 Cl2H2O2C3 A2B2C2D3 -553.13 3.75 -11.0 -1.18 0
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15314 437866 2 ON2C6H9 AB2C6D9 -55.37 3.22 -9.65 0.07 0
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15315 437923 1 O2H4C5N6 A2B4C5D6 124.05 1.12 -10.25 -2.33 0
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15316 437977 1 ClSN3O4H16C21 ABC3D4E16F21 -48.66 5.68 -9.28 -1.43 0
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15318 438020 2 O3H10C13 A3B10C13 -152.66 4.19 -8.9 -0.98 0
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15319 438021 2 O4H18C21 A4B18C21 -162.82 4.09 -8.26 -0.92 0
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15320 438025 2 O3H5C7 A3B5C7 -174.78 2.38 -10.7 -2.36 0
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15322 438027 1 O9H26C29 A9B26C29 -270.78 11.72 -8.18 -1.11 0
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15323 438028 1 O8H32C41 A8B32C41 -147.35 9.5 -8.68 -1.47 0
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15324 438029 2 O3H12C14 A3B12C14 -142.3 5.77 -8.69 -0.8 0
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15325 438030 1 NO3H11C13 AB3C11D13 -95.69 5.3 -8.87 -1.51 0
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15326 438031 1 NSiO6C25H39 ABC6D25E39 -316.15 5.33 -8.65 -0.7 0
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15327 438032 1 NO3H9C13 AB3C9D13 -67.51 4.59 -8.93 -1.54 0
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15329 438041 1 N3H15C17 A3B15C17 87.43 3.45 -8.47 -0.41 0
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15330 438042 1 ClN3O6C20H24 AB3C6D20E24 -97.33 6.35 -8.4 -0.6 0
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15331 438072 1 PtN2S2O10C18H30 AB2C2D10E18F30 -341.27 8.85 -8.7 -1.11 0
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15333 438187 1 BrO2F3N3H14C22 AB2C3D3E14F22 -105.48 6.67 0.0 0.0 1
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15334 438193 1 SO4N6H14C20 AB4C6D14E20 71.03 7.97 -9.64 -1.81 0
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15335 438200 2 O5H7C15 A5B7C15 -339.95 4.08 -8.76 -2.67 0
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15336 438250 1 NSnO4C18H18 ABC4D18E18 -21.32 8.17 0.0 0.0 -1
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15339 438327 1 SN2O2H6C7 AB2C2D6E7 0.5 3.18 -10.39 -1.12 2
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15340 438404 1 HC5 AB5 311.34 1.04 0.0 0.0 -3
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15343 438475 1 TiN3O4H31C32 AB3C4D31E32 -1.64 7.11 -8.57 -2.5 -2
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15344 438550 1 O2N4C21H24 A2B4C21D24 -11.51 2.49 -8.41 -0.99 0
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15345 438552 2 ON2C10H11 AB2C10D11 -4.14 3.25 -8.39 -0.97 0
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15346 438570 1 ON4C19H20 AB4C19D20 29.02 2.55 -8.28 -0.85 0
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15347 438574 1 F3N5O5C12H15 A3B5C5D12E15 -294.04 3.81 0.0 0.0 1
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15348 438579 4 ON2C26H40 AB2C26D40 -122.85 2.39 -8.87 -1.55 0
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15349 438587 1 NNiO6C13H14 ABC6D13E14 -183.23 9.21 0.0 0.0 0
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15354 438615 1 N2P2C6O7H14 A2B2C6D7E14 -384.06 4.97 -9.98 -0.66 0
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15355 438651 1 N5O5C10H13 A5B5C10D13 -152.09 3.53 -9.81 -0.71 2
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15356 439294 2 C3O3H5 A3B3C5 -257.28 2.57 -10.74 -0.52 0
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15357 439329 1 O6C19H24 A6B19C24 -266.47 6.78 -10.38 0.13 0
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15358 439338 1 OC21H34 AB21C34 -31.9 3.54 -9.51 0.44 0
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15359 439412 1 O11C21H22 A11B21C22 -418.73 7.53 -9.31 -0.93 0