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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165241 74520394 1 O4N6C25H40 A4B6C25D40 -161.79 5.89 -8.51 0.04 0
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165242 74520582 1 OS2N6C14H18 AB2C6D14E18 70.51 8.61 -9.14 -1.48 -1
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165243 74520726 1 SN4O4H13C23 AB4C4D13E23 48.33 8.16 0.0 0.0 1
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165244 74520767 1 ON2C17H25 AB2C17D25 5.46 1.87 0.0 0.0 0
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165245 74521054 1 ClO2N5C19H22 AB2C5D19E22 -11.82 3.96 -8.98 -0.36 0
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165246 74521092 1 NO5C20H21 AB5C20D21 -127.45 5.2 -8.92 -0.26 1
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165247 74521155 1 O2N3C23H26 A2B3C23D26 38.85 40.64 0.0 0.0 0
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165248 74521374 1 SF3N3O3C21H22 AB3C3D3E21F22 -214.22 4.51 -9.32 -0.95 -1
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165249 74521509 1 SN2O4C16H19 AB2C4D16E19 -122.88 9.76 0.0 0.0 0
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165250 74521510 1 SO3N8C23H26 AB3C8D23E26 -0.7 4.61 -9.41 -0.98 0
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165251 74521511 1 OS2N6C18H18 AB2C6D18E18 106.31 7.42 -9.25 -1.7 1
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165252 74521800 1 ClFNO2C27H34 ABCD2E27F34 -94.21 2.44 0.0 0.0 1
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165253 74521866 1 NO2C15H24 AB2C15D24 -55.49 2.9 0.0 0.0 0
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165254 74521963 1 SN3O3C15H19 AB3C3D15E19 -95.39 4.33 -8.84 -0.3 0
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165255 74521983 1 FSN2O3C16H21 ABC2D3E16F21 -164.39 4.34 -8.91 -0.56 1
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165256 74521984 1 N4O7H21C22 A4B7C21D22 -141.33 8.05 0.0 0.0 0
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165257 74521985 1 S2O3N4C14H22 A2B3C4D14E22 -97.67 8.19 -9.08 -0.69 -1
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165258 74522667 1 O2C10H17 A2B10C17 -59.52 5.1 0.0 0.0 1
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165259 74522843 1 FO2N3C21H27 AB2C3D21E27 -92.4 4.72 0.0 0.0 0
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165260 74523352 1 N3O6C14H17 A3B6C14D17 -160.44 8.08 -9.53 -1.33 0
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165261 74523353 1 FS2O3N5H18C21 AB2C3D5E18F21 -58.7 4.5 -9.21 -1.38 0
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165262 74523354 1 F3O3N5H18C21 A3B3C5D18E21 -168.32 4.32 -8.7 -1.24 1
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165263 74523529 1 ON2C21H33 AB2C21D33 -35.21 5.64 0.0 0.0 0
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165264 74523906 1 NS2O3H27C28 AB2C3D27E28 -25.81 6.99 -8.54 -1.42 0
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165265 74523997 1 OS2N4C17H22 AB2C4D17E22 33.76 11.98 -7.81 -0.83 0
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165266 74523998 1 SO2N4C17H22 AB2C4D17E22 -3.03 12.05 -7.85 -0.55 0
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165267 74523999 1 SO3N4C21H26 AB3C4D21E26 -55.12 12.21 -7.81 -0.6 1
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165268 74524000 1 ClSO3N4C21H26 ABC3D4E21F26 -58.85 4.46 0.0 0.0 0
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165269 74524027 1 OSN4C21H28 ABC4D21E28 12.03 12.0 -7.73 -0.41 -1
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165270 74524091 1 O3N5C15H16 A3B5C15D16 53.95 4.58 0.0 0.0 -2
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165271 74524371 2 NSO4H6C8 ABC4D6E8 -131.14 13.44 -8.33 -4.26 1
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165272 74524675 1 SO3N4C27H29 AB3C4D27E29 -2.74 2.95 0.0 0.0 1
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165273 74524742 1 N4O5H21C26 A4B5C21D26 -18.5 6.72 0.0 0.0 1
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165274 74524893 1 S2N4O4H21C24 A2B4C4D21E24 20.74 9.56 0.0 0.0 1
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165275 74524894 1 S2O3N4C20H23 A2B3C4D20E23 -20.4 7.38 0.0 0.0 1
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165276 74524895 1 ClO2S2N4H20C23 AB2C2D4E20F23 45.14 4.49 0.0 0.0 0
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165277 74525696 1 N3O7C25H29 A3B7C25D29 -127.76 13.16 -8.13 -1.0 0
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165278 74525697 1 N2O6C29H40 A2B6C29D40 -221.7 3.31 -8.15 -0.85 0
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165279 74525812 1 NSO3C18H19 ABC3D18E19 -64.93 8.14 -8.27 -0.69 0
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165280 74525863 1 N4O5C21H24 A4B5C21D24 -156.48 4.47 -9.41 -0.42 0
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165281 74526100 1 SO2N4C22H24 AB2C4D22E24 -14.19 4.01 -9.02 -0.62 0
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165282 74526101 1 SO3N5C17H21 AB3C5D17E21 -82.99 3.49 -9.16 -0.85 0
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165283 74526102 1 SO3N4C18H22 AB3C4D18E22 -81.36 2.46 -9.13 -0.72 0
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165284 74526103 1 FSO2N4C22H23 ABC2D4E22F23 -61.96 4.22 -9.09 -0.75 0
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165285 74526591 1 S2N4O4H14C17 A2B4C4D14E17 8.5 5.76 -8.94 -1.75 0
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165286 74526807 2 ON3C9H15 AB3C9D15 -74.7 3.7 -8.76 0.56 0
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165287 74526992 1 SO3N4C20H20 AB3C4D20E20 -30.75 4.98 -8.79 -1.55 0
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165288 74526993 1 SN4O4C20H20 AB4C4D20E20 -64.79 3.27 -8.33 -1.44 0
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165289 74527162 1 NO4C14H17 AB4C14D17 -144.78 6.69 -9.25 -1.01 0
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165290 74527368 1 SO2N3C17H17 AB2C3D17E17 -9.06 4.69 -8.6 -1.04 0