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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179184 76447689 1 SiO4C21H34 AB4C21D34 -226.99 5.2 -8.84 0.11 0
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179185 76447690 1 SiO4C21H36 AB4C21D36 -262.19 3.17 -8.88 0.22 0
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179186 76447701 2 OC15H24 AB15C24 -152.64 5.59 -9.39 0.46 0
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179187 76447838 1 O26C39H54 A26B39C54 -1166.48 6.62 -9.94 0.29 0
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179188 76447900 2 NO2C12H17 AB2C12D17 -179.58 5.24 -9.72 -0.45 0
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179189 76447901 1 N2O4C25H38 A2B4C25D38 -209.8 4.2 -9.58 -0.32 0
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179190 76448036 1 N9O11C43H71 A9B11C43D71 -576.92 7.31 -9.26 -0.6 0
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179191 76448037 1 NOC20H31 ABC20D31 -73.34 1.37 -8.74 0.99 0
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179192 76448269 1 NO3C20H39 AB3C20D39 -202.41 6.6 -10.27 0.78 0
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179193 76449099 4 O2C4H5 A2B4C5 -319.84 5.37 -9.36 -0.88 1
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179194 76449397 1 ClFSN2O4H17C19 ABCD2E4F17G19 -117.44 5.75 0.0 0.0 0
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179195 76450239 1 SO2N3H27C29 AB2C3D27E29 29.77 4.11 -8.7 -0.92 0
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179196 76450240 1 BrSO4N9C24H30 ABC4D9E24F30 11.74 4.22 -8.96 -1.35 0
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179197 76450241 1 O4C29H50 A4B29C50 -267.37 4.09 -9.27 1.36 0
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179198 76450242 1 O5C32H54 A5B32C54 -225.97 6.5 -6.53 -1.04 0
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179199 76450823 1 BrNSO3F4H36C47 ABCD3E4F36G47 -118.47 6.64 -9.42 -1.0 0
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179200 76450824 1 ON5H23C32 AB5C23D32 163.39 7.74 -8.43 -1.29 0
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179201 76450825 1 ClN2O4H17C22 AB2C4D17E22 -92.88 3.52 -8.48 -1.58 0
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179202 76450984 1 PN6O6C10H13 AB6C6D10E13 -213.11 8.5 -9.92 -1.33 0
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179203 76450985 1 PO5N6C10H13 AB5C6D10E13 -170.62 3.79 -9.96 -1.36 0
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179204 76450986 1 O25N28C96H150 A25B28C96D150 -723.56 53.34 -8.22 -1.99 1
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179205 76450987 1 N3O6C29H42 A3B6C29D42 -209.17 6.74 0.0 0.0 0
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179206 76450988 1 N2O2C13H16 A2B2C13D16 -42.02 4.17 -9.52 -0.04 0
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179207 76451058 1 NSiO5C28H51 ABC5D28E51 -332.77 6.64 -8.68 -0.38 0
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179208 76451126 1 NiSN5H31C51 ABC5D31E51 508.25 4.33 -7.12 -1.76 0