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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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174188 75737593 1 O2N5C20H24 A2B5C20D24 51.45 22.53 0.0 0.0 -1
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174189 75737754 1 SO4N5H16C21 AB4C5D16E21 12.16 11.84 0.0 0.0 -1
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174190 75737755 1 SN3O4H10C12 AB3C4D10E12 -64.06 7.75 0.0 0.0 -1
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174191 75737756 1 O3N4H23C24 A3B4C23D24 4.96 4.46 0.0 0.0 1
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174192 75737851 1 BrO2N3C21H27 AB2C3D21E27 -16.38 3.0 0.0 0.0 1
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174193 75737852 1 O4N5C25H32 A4B5C25D32 -96.83 5.84 0.0 0.0 1
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174194 75738452 1 ClO2N3C22H29 AB2C3D22E29 -46.7 4.2 0.0 0.0 1
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174195 75738594 1 ClO3N4C19H26 AB3C4D19E26 -71.77 4.69 0.0 0.0 1
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174196 75739006 1 NO4C24H30 AB4C24D30 -119.58 2.01 0.0 0.0 1
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174197 75739243 1 SO2N5C25H34 AB2C5D25E34 12.32 8.66 0.0 0.0 1
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174198 75739346 1 O3N5C25H32 A3B5C25D32 -60.14 5.47 0.0 0.0 2
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174199 75739400 1 BrSO2N4H21C23 ABC2D4E21F23 28.28 8.7 -7.32 -1.4 1
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174200 75739431 1 ClSO2N4H20C23 ABC2D4E20F23 24.49 3.86 0.0 0.0 1
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174201 75739490 1 BrION2C19H21 ABCD2E19F21 22.17 13.96 0.0 0.0 1
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174202 75739491 1 OSN3C25H30 ABC3D25E30 16.79 1.79 0.0 0.0 1
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174203 75739534 1 BrNC7H13 ABC7D13 19.31 5.73 0.0 0.0 1
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174204 75739692 1 ClN3C16H23 AB3C16D23 34.39 1.3 0.0 0.0 1
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174205 75739806 1 BrNO3C16H25 ABC3D16E25 -98.26 7.81 0.0 0.0 1
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174206 75740051 1 N2C16H21 A2B16C21 37.58 3.01 0.0 0.0 2
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174207 75740147 1 FON2C14H23 ABC2D14E23 -83.24 4.79 -9.12 0.19 -1
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174208 75740211 1 SN2O7C22H25 AB2C7D22E25 -210.14 4.24 0.0 0.0 1
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174209 75740652 1 ON2C17H37 AB2C17D37 -72.61 2.47 0.0 0.0 0
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174210 75741468 1 ON5C25H41 AB5C25D41 -38.25 5.69 -8.32 0.58 1
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174211 75741533 1 ON5C24H32 AB5C24D32 56.42 1.79 0.0 0.0 1
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174212 75741592 1 N2O2C23H31 A2B2C23D31 -35.79 2.24 0.0 0.0 1
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174213 75741593 1 ClN2O3C21H28 AB2C3D21E28 -77.34 2.56 0.0 0.0 1
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174214 75741594 1 N2O5C22H37 A2B5C22D37 -167.12 2.91 0.0 0.0 1
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174215 75741595 1 ON2C18H35 AB2C18D35 -48.62 2.75 0.0 0.0 1
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174216 75741596 1 O2N4C22H27 A2B4C22D27 -44.75 7.03 0.0 0.0 1
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174217 75741663 1 ON5C31H38 AB5C31D38 119.22 28.99 0.0 0.0 1
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174218 75741664 1 OSN4C16H25 ABC4D16E25 44.68 3.24 0.0 0.0 2
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174219 75742322 1 ON2F3C18H27 AB2C3D18E27 -190.73 1.07 -8.73 -0.51 1
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174220 75743215 1 O3N6C25H35 A3B6C25D35 32.26 6.44 0.0 0.0 1
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174221 75743216 1 O3N6C26H31 A3B6C26D31 63.38 6.01 0.0 0.0 1
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174222 75743234 1 O4N6C24H31 A4B6C24D31 6.6 7.52 0.0 0.0 1
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174223 75743318 1 ClFO2N3C18H22 ABC2D3E18F22 -63.67 3.57 0.0 0.0 1
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174224 75743650 1 BrN2O4C23H24 AB2C4D23E24 -45.99 18.52 0.0 0.0 1
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174225 75743677 1 Cl2N2C14H21 A2B2C14D21 8.84 9.52 0.0 0.0 2
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174226 75743678 3 NC6H11 AB6C11 27.4 10.78 -6.33 0.58 2
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174227 75743679 1 N2C15H26 A2B15C26 6.35 3.53 -8.72 0.2 2
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174228 75743680 1 SN2C15H26 AB2C15D26 13.19 3.08 -8.45 -0.09 1
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174229 75743681 1 N2C15H25 A2B15C25 20.18 5.73 0.0 0.0 2
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174230 75743682 1 ClN2C14H23 AB2C14D23 5.1 1.86 -8.77 -0.3 2
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174231 75743683 1 BrN2C14H23 AB2C14D23 16.77 2.03 -8.77 -0.36 2
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174232 75743684 1 FN2C14H23 AB2C14D23 -32.83 2.09 -8.75 -0.25 1
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174233 75743685 1 N2C18H25 A2B18C25 42.97 7.14 0.0 0.0 1
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174234 75743975 1 N4O6C27H33 A4B6C27D33 -157.09 2.67 0.0 0.0 1
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174235 75743977 1 N4C10H19 A4B10C19 58.0 1.77 0.0 0.0 1
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174236 75743978 1 N3C11H18 A3B11C18 58.04 5.09 0.0 0.0 1
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174237 75743979 1 N2O5C21H25 A2B5C21D25 -110.34 11.42 0.0 0.0 1