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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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266075 103558317 1 BrNO2C12H22 ABC2D12E22 -107.78 2.08 -9.52 -0.27 0
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266076 103558326 1 ClNO3C12H20 ABC3D12E20 -143.23 3.64 -9.55 0.41 0
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266077 103558342 1 BrNO2C13H22 ABC2D13E22 -109.14 5.0 -9.36 0.0 0
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266078 103558349 1 BrNO4C11H18 ABC4D11E18 -185.65 1.35 -9.75 -0.85 0
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266079 103558358 1 N2O3C16H24 A2B3C16D24 -118.34 7.14 -8.23 0.11 0
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266080 103558359 1 N2O2C15H28 A2B2C15D28 -122.65 4.86 -9.07 1.17 0
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266081 103558366 1 N2O2C11H20 A2B2C11D20 -83.13 4.35 -9.32 1.08 0
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266082 103558367 2 NOC6H11 ABC6D11 -87.1 4.65 -9.3 1.1 0
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266083 103558372 1 N2O2C11H20 A2B2C11D20 -74.21 6.98 -9.49 0.91 0
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266084 103558375 1 N2O3C13H24 A2B3C13D24 -140.17 2.25 -9.26 1.08 0
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266085 103558376 2 NOC7H13 ABC7D13 -113.0 5.57 -9.35 1.34 0
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266086 103558380 2 NOC6H12 ABC6D12 -118.65 3.63 -9.35 1.22 0
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266087 103558381 2 NOC8H12 ABC8D12 -77.91 4.37 -8.82 0.12 0
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266088 103558382 1 N2O2C11H22 A2B2C11D22 -96.65 3.21 -9.29 1.34 0
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266089 103558383 1 N2O3C12H24 A2B3C12D24 -134.23 2.88 -9.33 1.01 0
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266090 103558384 2 NOC6H12 ABC6D12 -103.59 1.82 -9.23 1.09 0
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266091 103558386 2 NOC6H12 ABC6D12 -109.43 3.62 -9.16 1.03 0
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266092 103558387 2 NOC6H12 ABC6D12 -113.34 4.98 -9.41 1.21 0
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266093 103558388 2 NOC6H12 ABC6D12 -106.7 2.47 -9.15 1.28 0
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266094 103558392 2 NOC6H11 ABC6D11 -91.69 3.44 -9.34 0.98 0
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266095 103558393 1 N2O3C12H22 A2B3C12D22 -130.36 3.78 -9.32 1.07 0
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266096 103558394 2 NOC7H13 ABC7D13 -102.09 5.3 -9.43 0.97 0
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266097 103558395 1 N2O2C13H24 A2B2C13D24 -84.1 4.52 -9.29 1.01 0
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266098 103558396 1 N2O3C14H26 A2B3C14D26 -148.07 1.61 -9.2 0.9 0
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266099 103558397 1 N2O2C13H24 A2B2C13D24 -100.09 4.28 -9.3 1.12 0