List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
5131 12638 1 NO2C4H7 AB2C4D7 -54.64 3.09 -10.53 0.43 0
5132 12639 1 NO2C5H9 AB2C5D9 -63.18 2.82 -10.4 0.52 0
5133 12642 1 ClOC4H7 ABC4D7 -47.95 1.51 -10.56 0.56 0
5134 12643 1 NO2C13H19 AB2C13D19 -87.79 2.73 -9.1 0.28 0
5135 12645 1 ON2C15H24 AB2C15D24 -53.34 4.26 -8.43 0.35 0
5136 12650 1 NO3C10H13 AB3C10D13 -120.86 5.69 -9.3 -0.31 0
5137 12651 1 O3C7H8 A3B7C8 -112.3 4.33 -9.67 -0.4 0
5138 12652 1 ClN5C11H12 AB5C11D12 51.16 2.98 -8.84 -0.57 0
5139 12653 1 ClNO2C10H12 ABC2D10E12 -90.0 3.32 -8.97 0.01 0
5140 12654 1 ON5C8H15 AB5C8D15 -9.95 3.75 -9.3 0.23 0
5141 12655 1 NO2C12H17 AB2C12D17 -83.33 1.9 -9.07 0.29 0
5142 12658 2 C5H8 A5B8 5.09 1.49 -8.19 0.27 0
5143 12659 6 CH2 AB2 -13.9 0.15 -9.54 1.45 0
5144 12660 1 COH4N4 ABC4D4 35.04 5.84 -8.7 -0.62 0
5145 12661 2 OC2H2 AB2C2 -44.63 3.74 -10.45 0.0 0
5146 12663 3 OC2H2 AB2C2 -99.68 4.33 -10.13 -0.28 0
5147 12664 3 CFN ABC -62.67 0.0 -12.15 -2.02 0
5148 12665 1 NOC5H9 ABC5D9 -58.0 4.82 -9.7 1.34 0
5149 12667 1 FNOC6H12 ABCD6E12 -118.83 3.41 -10.5 1.1 0
5150 12668 6 C2H3 A2B3 13.72 0.06 -9.25 1.43 0
5151 12669 1 CH4 AB4 -12.29 0.0 -13.67 6.02 0
5152 12670 1 CClMgH3 ABCD3 -46.29 3.21 -10.26 0.12 0
5153 12673 1 NOPC2Cl2H6 ABCD2E2F6 -122.35 4.75 -10.2 -0.47 0
5154 12675 1 C5F12 A5B12 -604.73 0.35 -13.9 -0.63 0
5155 12676 1 BrOC3F3H4 ABC3D3E4 -198.05 2.24 -11.24 -1.21 0