List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
351735 |
127282135 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-57.18 |
6.5 |
-9.24 |
-1.26 |
0 |
|
|
351736 |
127282136 |
1 |
O2N7C20H27 |
A2B7C20D27 |
6.23 |
9.96 |
-9.35 |
-1.28 |
0 |
|
|
351737 |
127282137 |
1 |
O2N7C19H27 |
A2B7C19D27 |
-14.19 |
6.99 |
-9.06 |
-1.25 |
0 |
|
|
351738 |
127282138 |
1 |
N3O3C22H35 |
A3B3C22D35 |
-161.75 |
4.44 |
-9.14 |
0.62 |
0 |
|
|
351739 |
127282139 |
1 |
O2N6C21H30 |
A2B6C21D30 |
-43.95 |
1.25 |
-9.17 |
-0.89 |
0 |
|
|
351740 |
127282140 |
1 |
SO2N4C18H28 |
AB2C4D18E28 |
-88.03 |
3.41 |
-8.96 |
-0.75 |
0 |
|
|
351741 |
127282141 |
1 |
O2N5C20H33 |
A2B5C20D33 |
-87.81 |
5.88 |
-8.9 |
0.82 |
0 |
|
|
351742 |
127282142 |
1 |
O2N6C17H28 |
A2B6C17D28 |
-58.21 |
4.26 |
-9.26 |
0.07 |
0 |
|
|
351743 |
127282143 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-61.4 |
6.51 |
-8.81 |
-0.9 |
0 |
|
|
351744 |
127282144 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-73.13 |
6.67 |
-8.8 |
0.19 |
0 |
|
|
351745 |
127282145 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-110.36 |
5.54 |
-8.96 |
-1.24 |
0 |
|
|
351746 |
127282146 |
1 |
SO2N3C21H29 |
AB2C3D21E29 |
-82.99 |
4.65 |
-8.68 |
-0.17 |
0 |
|
|
351747 |
127282147 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-81.63 |
7.31 |
-8.53 |
-0.06 |
0 |
|
|
351748 |
127282148 |
1 |
O2N6C21H30 |
A2B6C21D30 |
-41.74 |
5.37 |
-9.03 |
-0.72 |
0 |
|
|
351749 |
127282149 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-82.67 |
5.66 |
-8.83 |
0.37 |
0 |
|
|
351750 |
127282150 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-68.2 |
4.9 |
-9.34 |
-1.18 |
0 |
|
|
351751 |
127282151 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-128.3 |
4.04 |
-8.84 |
-0.09 |
0 |
|
|
351752 |
127282152 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-54.72 |
4.47 |
-8.78 |
-0.82 |
0 |
|
|
351753 |
127282153 |
1 |
O3N5C19H29 |
A3B5C19D29 |
-119.47 |
6.47 |
-9.11 |
-1.09 |
0 |
|
|
351754 |
127282154 |
1 |
FO2N3C22H30 |
AB2C3D22E30 |
-115.01 |
4.02 |
-9.09 |
-0.23 |
0 |
|
|
351755 |
127282155 |
1 |
N3O4C21H29 |
A3B4C21D29 |
-152.62 |
6.84 |
-8.91 |
-0.34 |
0 |
|
|
351756 |
127282156 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-81.98 |
3.95 |
-8.42 |
-0.08 |
0 |
|
|
351757 |
127282157 |
1 |
O2N3C21H35 |
A2B3C21D35 |
-118.53 |
5.38 |
-8.96 |
0.95 |
0 |
|
|
351758 |
127282158 |
1 |
O2N7C20H29 |
A2B7C20D29 |
-26.06 |
7.25 |
-9.02 |
-1.09 |
0 |
|
|
351759 |
127282159 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-80.48 |
3.22 |
-9.14 |
0.45 |
0 |
|
|
351760 |
127282160 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-133.67 |
4.24 |
-8.96 |
-0.57 |
0 |
|
|
351761 |
127282161 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-59.44 |
4.49 |
-9.11 |
0.27 |
0 |
|
|
351762 |
127282162 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-93.78 |
3.91 |
-8.81 |
-0.22 |
0 |
|
|
351763 |
127282163 |
1 |
O2N5C21H35 |
A2B5C21D35 |
-92.85 |
2.22 |
-8.91 |
0.93 |
0 |
|
|
351764 |
127282164 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-51.92 |
5.93 |
-9.01 |
-0.94 |
0 |
|
|
351765 |
127282165 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-70.59 |
7.09 |
-8.62 |
-0.24 |
0 |
|
|
351766 |
127282166 |
1 |
O2N3C19H31 |
A2B3C19D31 |
-105.8 |
5.05 |
-8.99 |
0.85 |
0 |
|
|
351767 |
127282167 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-43.35 |
1.81 |
-8.71 |
-0.85 |
0 |
|
|
351768 |
127282168 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-35.1 |
6.13 |
-9.18 |
-1.35 |
0 |
|
|
351769 |
127282169 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-20.44 |
3.38 |
-9.2 |
-1.22 |
0 |
|
|
351770 |
127282170 |
1 |
O4N5C18H27 |
A4B5C18D27 |
-179.87 |
1.53 |
-9.28 |
-0.78 |
0 |
|
|
351771 |
127282171 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-35.02 |
4.18 |
-9.15 |
-0.44 |
0 |
|
|
351772 |
127282172 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-127.41 |
4.02 |
-8.89 |
0.17 |
0 |
|
|
351773 |
127282173 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-94.36 |
6.53 |
-8.93 |
-0.37 |
0 |
|
|
351774 |
127282174 |
1 |
SO2N3C20H29 |
AB2C3D20E29 |
-79.94 |
6.15 |
-8.96 |
-0.46 |
0 |
|
|
351775 |
127282175 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-109.84 |
2.86 |
-9.1 |
-0.85 |
0 |
|
|
351776 |
127282176 |
1 |
SO2N5C17H27 |
AB2C5D17E27 |
-56.73 |
5.38 |
-9.28 |
-1.33 |
0 |
|
|
351777 |
127282177 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-101.3 |
5.52 |
-8.91 |
-0.76 |
0 |
|
|
351778 |
127282178 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-116.67 |
4.27 |
-9.01 |
0.06 |
0 |
|
|
351779 |
127282179 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-30.52 |
4.7 |
-9.0 |
-0.76 |
0 |
|
|
351780 |
127282180 |
1 |
O4N5C18H29 |
A4B5C18D29 |
-181.14 |
5.9 |
-8.96 |
-0.27 |
0 |
|
|
351781 |
127282181 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-61.74 |
2.68 |
-8.89 |
0.1 |
0 |
|
|
351782 |
127282182 |
1 |
O2N7C15H25 |
A2B7C15D25 |
-23.5 |
3.42 |
-9.25 |
-0.77 |
0 |
|
|
351783 |
127282183 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-165.99 |
6.29 |
-9.12 |
0.6 |
0 |
|
|
351784 |
127282184 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-71.69 |
3.6 |
-9.09 |
-0.77 |
0 |
|
|
351785 |
127282185 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-101.38 |
4.09 |
-9.1 |
-0.33 |
0 |
|
|
351786 |
127282186 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-105.31 |
4.78 |
-9.08 |
-0.24 |
0 |
|
|
351787 |
127282187 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-111.36 |
4.84 |
-9.07 |
-0.17 |
0 |
|
|
351788 |
127282188 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-201.44 |
7.02 |
-9.0 |
-0.22 |
0 |
|
|
351789 |
127282189 |
1 |
SN3O4C18H31 |
AB3C4D18E31 |
-203.37 |
9.04 |
-9.27 |
0.5 |
0 |
|
|
351790 |
127282190 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-156.95 |
4.09 |
-8.96 |
0.39 |
0 |
|
|
351791 |
127282191 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-99.59 |
5.92 |
-8.94 |
-0.01 |
0 |
|
|
351792 |
127282192 |
1 |
SO3N4C17H28 |
AB3C4D17E28 |
-144.04 |
2.65 |
-9.06 |
-0.3 |
0 |
|
|
351793 |
127282193 |
2 |
ON2C11H14 |
AB2C11D14 |
-51.01 |
3.16 |
-9.19 |
-1.09 |
0 |
|
|
351794 |
127282194 |
1 |
O4N5C19H29 |
A4B5C19D29 |
-178.47 |
2.07 |
-9.25 |
-0.69 |
0 |
|
|
351795 |
127282195 |
1 |
SO3N4C19H30 |
AB3C4D19E30 |
-146.07 |
3.41 |
-8.9 |
-0.32 |
0 |
|
|
351796 |
127282196 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-61.81 |
6.02 |
-8.9 |
-0.84 |
0 |
|
|
351797 |
127282197 |
1 |
O2N3C19H31 |
A2B3C19D31 |
-103.34 |
5.29 |
-9.01 |
0.85 |
0 |
|
|
351798 |
127282198 |
2 |
ON2C11H15 |
AB2C11D15 |
-63.94 |
7.42 |
-8.67 |
-0.29 |
0 |
|
|
351799 |
127282199 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-30.33 |
4.05 |
-9.09 |
-0.9 |
0 |
|
|
351800 |
127282200 |
1 |
SO2N3C19H29 |
AB2C3D19E29 |
-85.83 |
4.36 |
-9.02 |
-0.24 |
0 |
|
|
351801 |
127282201 |
2 |
ON2C11H14 |
AB2C11D14 |
-50.16 |
6.79 |
-8.96 |
-1.13 |
0 |
|
|
351802 |
127282202 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-38.53 |
2.66 |
-9.15 |
-0.65 |
0 |
|
|
351803 |
127282203 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-160.18 |
4.43 |
-9.09 |
0.72 |
0 |
|
|
351804 |
127282204 |
1 |
O3N5C17H25 |
A3B5C17D25 |
-99.88 |
2.79 |
-9.23 |
-1.24 |
0 |
|
|
351805 |
127282205 |
1 |
SO2N4C20H26 |
AB2C4D20E26 |
-50.36 |
4.48 |
-9.12 |
-1.2 |
0 |
|
|
351806 |
127282206 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-150.96 |
8.23 |
-9.29 |
0.41 |
0 |
|
|
351807 |
127282207 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-40.66 |
7.52 |
-8.79 |
-0.59 |
0 |
|
|
351808 |
127282208 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-62.72 |
6.38 |
-9.16 |
-0.96 |
0 |
|
|
351809 |
127282209 |
1 |
SO2N3C18H27 |
AB2C3D18E27 |
-80.88 |
5.11 |
-9.01 |
-0.34 |
0 |