List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
338095 |
127258726 |
1 |
NO3C7H13 |
AB3C7D13 |
-95.3 |
3.57 |
-9.89 |
-0.07 |
0 |
|
|
338096 |
127258727 |
1 |
ClNO2C15H20 |
ABC2D15E20 |
-88.14 |
0.98 |
-9.1 |
-0.14 |
0 |
|
|
338097 |
127258728 |
1 |
NCl2O2C11H11 |
AB2C2D11E11 |
-73.75 |
0.95 |
-9.24 |
-0.42 |
0 |
|
|
338098 |
127258729 |
1 |
ClNO2C15H20 |
ABC2D15E20 |
-95.49 |
0.61 |
-9.09 |
-0.1 |
0 |
|
|
338099 |
127258730 |
1 |
ClNO2C14H18 |
ABC2D14E18 |
-85.84 |
0.92 |
-9.14 |
-0.15 |
0 |
|
|
338100 |
127258731 |
1 |
NCl2O2C12H13 |
AB2C2D12E13 |
-78.42 |
0.99 |
-9.22 |
-0.42 |
0 |
|
|
338101 |
127258732 |
1 |
ClNO2C14H18 |
ABC2D14E18 |
-89.64 |
1.11 |
-8.96 |
-0.08 |
0 |
|
|
338102 |
127258733 |
1 |
ClNO2C11H12 |
ABC2D11E12 |
-72.45 |
0.52 |
-9.14 |
-0.17 |
0 |
|
|
338103 |
127258734 |
1 |
ClNO3C11H12 |
ABC3D11E12 |
-124.58 |
2.77 |
-9.94 |
-0.4 |
0 |
|
|
338104 |
127258735 |
1 |
ClNO2C16H16 |
ABC2D16E16 |
-55.09 |
1.24 |
-8.85 |
-0.62 |
0 |
|
|
338105 |
127258797 |
1 |
ClNO2C15H20 |
ABC2D15E20 |
-83.35 |
1.29 |
-9.22 |
-0.31 |
0 |
|
|
338106 |
127258798 |
1 |
NO2C17H25 |
AB2C17D25 |
-93.38 |
2.09 |
-8.91 |
0.1 |
0 |
|
|
338107 |
127258799 |
1 |
NO2C23H37 |
AB2C23D37 |
-124.76 |
1.8 |
-8.95 |
0.2 |
0 |
|
|
338108 |
127258800 |
1 |
NSO2C17H25 |
ABC2D17E25 |
-86.84 |
3.5 |
-8.59 |
-0.28 |
0 |
|
|
338109 |
127258801 |
1 |
NO2C16H23 |
AB2C16D23 |
-86.09 |
2.25 |
-9.14 |
0.02 |
0 |
|
|
338110 |
127258802 |
1 |
NO2C16H17 |
AB2C16D17 |
-43.5 |
2.36 |
-8.8 |
-0.56 |
0 |
|
|
338111 |
127258803 |
1 |
NO3C15H21 |
AB3C15D21 |
-112.96 |
2.91 |
-8.85 |
-0.15 |
0 |
|
|
338112 |
127258804 |
1 |
NO2C15H21 |
AB2C15D21 |
-78.15 |
2.59 |
-9.09 |
0.02 |
0 |
|
|
338113 |
127258805 |
1 |
ClNO2C12H14 |
ABC2D12E14 |
-68.32 |
1.11 |
-9.24 |
-0.32 |
0 |
|
|
338114 |
127258806 |
1 |
NO2C14H19 |
AB2C14D19 |
-79.31 |
1.04 |
-8.9 |
0.11 |
0 |
|
|
338115 |
127258807 |
1 |
NO2C18H27 |
AB2C18D27 |
-99.65 |
1.78 |
-9.04 |
0.14 |
0 |
|
|
338116 |
127258808 |
1 |
NO2C16H23 |
AB2C16D23 |
-90.14 |
1.75 |
-9.05 |
0.13 |
0 |
|
|
338117 |
127258809 |
2 |
NOC7H10 |
ABC7D10 |
-62.69 |
0.75 |
-8.24 |
0.18 |
0 |
|
|
338118 |
127258810 |
1 |
NSO2C14H19 |
ABC2D14E19 |
-71.84 |
3.56 |
-8.6 |
-0.28 |
0 |
|
|
338119 |
127258811 |
1 |
NO2H13C14 |
AB2C13D14 |
-34.13 |
2.51 |
-8.79 |
-0.55 |
0 |
|
|
338120 |
127258812 |
1 |
NO2C13H17 |
AB2C13D17 |
-76.03 |
1.72 |
-9.03 |
0.04 |
0 |
|
|
338121 |
127258813 |
1 |
NCl2O2H9C10 |
AB2C2D9E10 |
-67.42 |
3.01 |
-9.3 |
-0.65 |
0 |
|
|
338122 |
127258814 |
1 |
NO2C12H15 |
AB2C12D15 |
-68.66 |
1.62 |
-9.1 |
0.02 |
0 |
|
|
338123 |
127258815 |
1 |
NO4C13H15 |
AB4C13D15 |
-131.37 |
2.36 |
-9.22 |
-0.22 |
0 |
|
|
338124 |
127258816 |
1 |
NO2S2C14H17 |
AB2C2D14E17 |
-54.33 |
2.74 |
-8.52 |
-0.2 |
0 |
|
|
338125 |
127258817 |
1 |
NO2C15H21 |
AB2C15D21 |
-78.07 |
2.69 |
-9.06 |
0.05 |
0 |
|
|
338126 |
127258818 |
1 |
NO3C13H17 |
AB3C13D17 |
-103.15 |
2.91 |
-8.84 |
-0.14 |
0 |
|
|
338127 |
127258819 |
1 |
NO2C13H17 |
AB2C13D17 |
-68.58 |
2.64 |
-9.09 |
0.03 |
0 |
|
|
338128 |
127258820 |
1 |
NO2C14H19 |
AB2C14D19 |
-73.25 |
2.53 |
-9.1 |
0.01 |
0 |
|
|
338129 |
127258821 |
1 |
ClNO4C13H16 |
ABC4D13E16 |
-142.68 |
0.92 |
-9.08 |
-0.31 |
0 |
|
|
338130 |
127258822 |
1 |
NO2C13H15 |
AB2C13D15 |
-41.14 |
2.28 |
-9.18 |
-0.08 |
0 |
|
|
338131 |
127258823 |
1 |
NO3C14H19 |
AB3C14D19 |
-102.49 |
3.47 |
-8.74 |
-0.03 |
0 |
|
|
338132 |
127258824 |
1 |
ClNO2C10H10 |
ABC2D10E10 |
-58.88 |
1.23 |
-9.22 |
-0.3 |
0 |
|
|
338133 |
127258825 |
1 |
NO2C16H21 |
AB2C16D21 |
-70.71 |
2.53 |
-9.09 |
0.02 |
0 |
|
|
338134 |
127258826 |
1 |
NO3C12H15 |
AB3C12D15 |
-92.57 |
2.12 |
-8.9 |
-0.12 |
0 |
|
|
338135 |
127258827 |
1 |
NO2C12H15 |
AB2C12D15 |
-63.39 |
2.08 |
-9.16 |
-0.08 |
0 |
|
|
338136 |
127258828 |
1 |
FNO2C10H10 |
ABC2D10E10 |
-95.19 |
1.09 |
-9.25 |
-0.29 |
0 |
|
|
338137 |
127258829 |
1 |
NO2C14H19 |
AB2C14D19 |
-78.78 |
2.01 |
-8.97 |
0.07 |
0 |
|
|
338138 |
127258830 |
1 |
NO2C12H15 |
AB2C12D15 |
-69.56 |
2.27 |
-8.89 |
0.13 |
0 |
|
|
338139 |
127258831 |
1 |
NO2C18H27 |
AB2C18D27 |
-100.33 |
1.76 |
-8.96 |
0.19 |
0 |
|
|
338140 |
127258832 |
1 |
NO2C16H23 |
AB2C16D23 |
-90.66 |
1.61 |
-9.02 |
0.16 |
0 |
|
|
338141 |
127258833 |
1 |
NCl2O2H9C10 |
AB2C2D9E10 |
-70.24 |
4.05 |
-9.49 |
-0.61 |
0 |
|
|
338142 |
127258834 |
1 |
NO2C14H19 |
AB2C14D19 |
-80.28 |
1.94 |
-9.06 |
0.12 |
0 |
|
|
338143 |
127258835 |
1 |
NO2C12H15 |
AB2C12D15 |
-72.65 |
1.78 |
-9.06 |
0.15 |
0 |
|
|
338144 |
127258836 |
1 |
NO2C14H19 |
AB2C14D19 |
-75.8 |
2.53 |
-9.07 |
0.1 |
0 |
|
|
338145 |
127258837 |
1 |
NO2C13H17 |
AB2C13D17 |
-70.75 |
1.43 |
-9.11 |
0.06 |
0 |
|
|
338146 |
127258838 |
2 |
NOC6H8 |
ABC6D8 |
-52.8 |
3.38 |
-8.32 |
0.18 |
0 |
|
|
338147 |
127258839 |
1 |
NO3C11H13 |
AB3C11D13 |
-93.36 |
3.82 |
-8.99 |
-0.04 |
0 |
|
|
338148 |
127258840 |
1 |
NSO2C12H15 |
ABC2D12E15 |
-62.22 |
2.53 |
-8.54 |
-0.25 |
0 |
|
|
338149 |
127258841 |
1 |
NO2C14H19 |
AB2C14D19 |
-81.52 |
1.88 |
-9.04 |
0.15 |
0 |
|
|
338150 |
127258842 |
1 |
NO2C11H13 |
AB2C11D13 |
-61.79 |
2.52 |
-9.11 |
0.05 |
0 |
|
|
338151 |
127258843 |
1 |
NO4C13H15 |
AB4C13D15 |
-126.85 |
3.39 |
-9.38 |
-0.75 |
0 |
|
|
338152 |
127258844 |
1 |
NSO2C11H13 |
ABC2D11E13 |
-52.18 |
2.6 |
-8.52 |
-0.31 |
0 |
|
|
338153 |
127258845 |
1 |
NSO3C13H15 |
ABC3D13E15 |
-89.57 |
3.24 |
-8.8 |
-0.71 |
0 |
|
|
338154 |
127258846 |
1 |
BrClNO2H9C10 |
ABCD2E9F10 |
-55.07 |
3.26 |
-9.35 |
-0.76 |
0 |
|
|
338155 |
127258847 |
1 |
BrNO2C10H10 |
ABC2D10E10 |
-48.8 |
3.76 |
-9.29 |
-0.4 |
0 |
|
|
338156 |
127258848 |
2 |
NO2C5H5 |
AB2C5D5 |
-56.91 |
8.1 |
-9.69 |
-1.38 |
0 |
|
|
338157 |
127258849 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-161.2 |
4.75 |
-9.44 |
-0.06 |
0 |
|
|
338158 |
127258850 |
1 |
NO2C12H23 |
AB2C12D23 |
-119.37 |
2.46 |
-9.14 |
0.75 |
0 |
|
|
338159 |
127258851 |
1 |
NO4C26H53 |
AB4C26D53 |
-287.28 |
1.5 |
-9.95 |
0.48 |
0 |
|
|
338160 |
127258852 |
1 |
BrN2O4C13H15 |
AB2C4D13E15 |
-65.46 |
8.77 |
-9.68 |
-1.59 |
0 |
|
|
338161 |
127258853 |
1 |
ClN2O4C14H17 |
AB2C4D14E17 |
-84.61 |
7.3 |
-9.51 |
-1.36 |
0 |
|
|
338162 |
127258854 |
1 |
N2O2C19H28 |
A2B2C19D28 |
-56.9 |
2.06 |
-9.02 |
0.36 |
0 |
|
|
338163 |
127258855 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-89.25 |
3.49 |
-8.7 |
0.4 |
0 |
|
|
338164 |
127258856 |
2 |
NOC7H11 |
ABC7D11 |
-78.9 |
3.98 |
-8.78 |
0.35 |
0 |
|
|
338165 |
127258857 |
1 |
NO2C13H23 |
AB2C13D23 |
-113.88 |
2.81 |
-9.6 |
1.0 |
0 |
|
|
338166 |
127258858 |
1 |
ClN2O4C15H17 |
AB2C4D15E17 |
-81.67 |
8.54 |
-9.65 |
-1.62 |
0 |
|
|
338167 |
127258859 |
1 |
NaN2O3C10H11 |
AB2C3D10E11 |
-159.39 |
10.38 |
-9.02 |
-0.84 |
0 |
|
|
338168 |
127258860 |
1 |
SN2O4C9H12 |
AB2C4D9E12 |
-170.27 |
4.55 |
-9.61 |
-0.73 |
0 |
|
|
338169 |
127258861 |
1 |
N4O4H20C23 |
A4B4C20D23 |
-28.91 |
3.65 |
-9.03 |
-0.91 |
0 |