List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
358185 |
127295730 |
2 |
ON3C9H15 |
AB3C9D15 |
-64.18 |
5.82 |
-9.44 |
-0.12 |
0 |
|
|
358186 |
127295731 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-129.91 |
4.55 |
-8.96 |
0.14 |
0 |
|
|
358187 |
127295732 |
1 |
OSN6C18H26 |
ABC6D18E26 |
6.12 |
4.95 |
-8.32 |
-0.58 |
0 |
|
|
358188 |
127295733 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-134.36 |
4.85 |
-8.98 |
-0.04 |
0 |
|
|
358189 |
127295734 |
1 |
SO2N3C22H29 |
AB2C3D22E29 |
-67.61 |
4.8 |
-8.9 |
-0.78 |
0 |
|
|
358190 |
127295735 |
1 |
ClSO2N3C19H28 |
ABC2D3E19F28 |
-89.16 |
2.94 |
-9.32 |
-0.44 |
0 |
|
|
358191 |
127295736 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-34.79 |
3.9 |
-9.07 |
-0.83 |
0 |
|
|
358192 |
127295737 |
2 |
ON2C9H16 |
AB2C9D16 |
-119.96 |
4.27 |
-8.74 |
0.92 |
0 |
|
|
358193 |
127295738 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-163.15 |
4.44 |
-9.05 |
0.78 |
0 |
|
|
358194 |
127295739 |
1 |
F2O2N3C21H29 |
A2B2C3D21E29 |
-185.18 |
5.38 |
-9.34 |
-0.51 |
0 |
|
|
358195 |
127295740 |
1 |
OSN5C18H25 |
ABC5D18E25 |
-2.5 |
3.29 |
-9.1 |
-0.55 |
0 |
|
|
358196 |
127295741 |
1 |
ON5C21H33 |
AB5C21D33 |
-32.9 |
4.93 |
-8.96 |
-0.03 |
0 |
|
|
358197 |
127295742 |
1 |
OSN4C16H26 |
ABC4D16E26 |
-21.83 |
2.94 |
-8.75 |
-0.49 |
0 |
|
|
358198 |
127295743 |
1 |
O2N4C21H38 |
A2B4C21D38 |
-134.23 |
5.35 |
-8.98 |
1.02 |
0 |
|
|
358199 |
127295744 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-92.05 |
5.43 |
-8.6 |
0.13 |
0 |
|
|
358200 |
127295745 |
1 |
ON3C15H27 |
AB3C15D27 |
-54.35 |
4.68 |
-8.88 |
1.24 |
0 |
|
|
358201 |
127295746 |
2 |
ON2C8H14 |
AB2C8D14 |
-87.52 |
2.39 |
-8.96 |
0.94 |
0 |
|
|
358202 |
127295747 |
1 |
O3N4C17H30 |
A3B4C17D30 |
-147.76 |
2.5 |
-8.81 |
0.66 |
0 |
|
|
358203 |
127295748 |
1 |
N3O4C15H27 |
A3B4C15D27 |
-191.38 |
2.1 |
-9.03 |
0.53 |
0 |
|
|
358204 |
127295749 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-91.88 |
6.57 |
-9.16 |
-0.82 |
0 |
|
|
358205 |
127295750 |
1 |
ClO2N4C16H21 |
AB2C4D16E21 |
-52.56 |
0.9 |
-9.26 |
-1.01 |
0 |
|
|
358206 |
127295751 |
1 |
ON5C22H35 |
AB5C22D35 |
-39.11 |
5.22 |
-8.34 |
0.09 |
0 |
|
|
358207 |
127295752 |
1 |
ON5C22H35 |
AB5C22D35 |
-38.5 |
3.63 |
-8.28 |
0.18 |
0 |
|
|
358208 |
127295753 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-127.08 |
3.75 |
-9.15 |
-0.14 |
0 |
|
|
358209 |
127295754 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-103.95 |
3.44 |
-9.24 |
0.12 |
0 |
|
|
358210 |
127295755 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-54.15 |
3.62 |
-9.71 |
-0.82 |
0 |
|
|
358211 |
127295756 |
1 |
O3N5C18H33 |
A3B5C18D33 |
-165.85 |
3.54 |
-8.82 |
0.62 |
0 |
|
|
358212 |
127295757 |
1 |
O3N5C18H33 |
A3B5C18D33 |
-161.51 |
3.82 |
-8.78 |
0.59 |
0 |
|
|
358213 |
127295758 |
3 |
NOC5H9 |
ABC5D9 |
-156.54 |
2.28 |
-9.25 |
0.72 |
0 |
|
|
358214 |
127295759 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-181.89 |
4.97 |
-9.24 |
1.0 |
0 |
|
|
358215 |
127295760 |
2 |
ON3C9H15 |
AB3C9D15 |
-53.83 |
2.88 |
-8.47 |
0.12 |
0 |
|
|
358216 |
127295761 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-110.82 |
4.9 |
-8.93 |
1.21 |
0 |
|
|
358217 |
127295762 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-162.9 |
3.11 |
-9.42 |
0.82 |
0 |
|
|
358218 |
127295763 |
1 |
N2O3C13H24 |
A2B3C13D24 |
-152.88 |
3.11 |
-9.39 |
1.08 |
0 |
|
|
358219 |
127295764 |
1 |
N2O3C19H30 |
A2B3C19D30 |
-142.77 |
4.8 |
-8.78 |
0.67 |
0 |
|
|
358220 |
127295765 |
2 |
ON2C7H12 |
AB2C7D12 |
-62.83 |
4.05 |
-9.15 |
0.73 |
0 |
|
|
358221 |
127295766 |
1 |
ON5C18H29 |
AB5C18D29 |
-26.98 |
4.55 |
-8.76 |
0.76 |
0 |
|
|
358222 |
127295767 |
1 |
O2N5C21H33 |
A2B5C21D33 |
-81.31 |
7.39 |
-9.26 |
0.6 |
0 |
|
|
358223 |
127295768 |
1 |
ON5C16H27 |
AB5C16D27 |
-31.2 |
9.78 |
-9.1 |
0.77 |
0 |
|
|
358224 |
127295769 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-84.11 |
5.55 |
-9.3 |
0.49 |
0 |
|
|
358225 |
127295770 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-141.86 |
2.54 |
-9.25 |
1.02 |
0 |
|
|
358226 |
127295771 |
3 |
NOC5H9 |
ABC5D9 |
-141.07 |
4.91 |
-8.98 |
1.13 |
0 |
|
|
358227 |
127295772 |
1 |
N3O4C18H31 |
A3B4C18D31 |
-194.37 |
5.16 |
-9.52 |
0.83 |
0 |
|
|
358228 |
127295773 |
1 |
N2O4C13H24 |
A2B4C13D24 |
-185.06 |
2.0 |
-9.32 |
1.05 |
0 |
|
|
358229 |
127295774 |
1 |
SO2N4C17H26 |
AB2C4D17E26 |
-69.94 |
4.73 |
-9.37 |
-0.87 |
0 |
|
|
358230 |
127295775 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-107.56 |
3.7 |
-8.87 |
-0.28 |
0 |
|
|
358231 |
127295776 |
1 |
O2N3C23H35 |
A2B3C23D35 |
-105.8 |
5.18 |
-9.12 |
0.42 |
0 |
|
|
358232 |
127295777 |
1 |
O2N4C19H34 |
A2B4C19D34 |
-130.63 |
3.81 |
-8.71 |
0.96 |
0 |
|
|
358233 |
127295778 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-135.46 |
3.2 |
-8.92 |
0.12 |
0 |
|
|
358234 |
127295779 |
1 |
FO2N3C22H32 |
AB2C3D22E32 |
-148.5 |
1.7 |
-9.21 |
-0.06 |
0 |
|
|
358235 |
127295780 |
2 |
OSN2C8H13 |
ABC2D8E13 |
-66.1 |
4.1 |
-8.52 |
-0.73 |
0 |
|
|
358236 |
127295781 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-70.4 |
2.86 |
-9.32 |
0.63 |
0 |
|
|
358237 |
127295782 |
1 |
FO2N3C22H30 |
AB2C3D22E30 |
-142.12 |
4.61 |
-9.4 |
-0.22 |
0 |
|
|
358238 |
127295783 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-100.96 |
3.52 |
-9.21 |
0.18 |
0 |
|
|
358239 |
127295784 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-89.28 |
4.31 |
-8.47 |
-0.17 |
0 |
|
|
358240 |
127295785 |
1 |
N2O4C21H32 |
A2B4C21D32 |
-168.58 |
4.32 |
-8.96 |
-0.02 |
0 |
|
|
358241 |
127295786 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-77.09 |
0.71 |
-8.8 |
0.1 |
0 |
|
|
358242 |
127295787 |
1 |
SO3N4C16H30 |
AB3C4D16E30 |
-152.89 |
5.02 |
-8.8 |
0.57 |
0 |
|
|
358243 |
127295788 |
1 |
SN3O4C14H27 |
AB3C4D14E27 |
-188.69 |
4.01 |
-9.19 |
0.39 |
0 |
|
|
358244 |
127295789 |
1 |
N2O3C22H34 |
A2B3C22D34 |
-139.59 |
3.57 |
-8.85 |
0.07 |
0 |
|
|
358245 |
127295790 |
1 |
O2N3C23H35 |
A2B3C23D35 |
-110.0 |
5.02 |
-9.06 |
0.37 |
0 |
|
|
358246 |
127295791 |
1 |
SO2N3C19H29 |
AB2C3D19E29 |
-94.78 |
1.89 |
-9.09 |
-0.36 |
0 |
|
|
358247 |
127295792 |
2 |
ON2C10H14 |
AB2C10D14 |
-76.01 |
5.63 |
-8.71 |
0.11 |
0 |
|
|
358248 |
127295793 |
1 |
ClO2N3C21H30 |
AB2C3D21E30 |
-103.05 |
4.21 |
-9.31 |
-0.2 |
0 |
|
|
358249 |
127295794 |
2 |
ON2C9H16 |
AB2C9D16 |
-121.07 |
6.95 |
-8.71 |
1.22 |
0 |
|
|
358250 |
127295795 |
1 |
OSN4C18H30 |
ABC4D18E30 |
-53.48 |
2.95 |
-8.72 |
-0.48 |
0 |
|
|
358251 |
127295796 |
1 |
O2N3C24H31 |
A2B3C24D31 |
-69.18 |
3.82 |
-8.97 |
-0.61 |
0 |
|
|
358252 |
127295797 |
2 |
ON2C8H14 |
AB2C8D14 |
-98.6 |
3.41 |
-8.94 |
0.45 |
0 |
|
|
358253 |
127295798 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-151.72 |
4.84 |
-9.58 |
0.26 |
0 |
|
|
358254 |
127295799 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-142.08 |
4.87 |
-9.32 |
0.42 |
0 |
|
|
358255 |
127295800 |
2 |
NO2C10H15 |
AB2C10D15 |
-165.75 |
5.48 |
-8.73 |
0.02 |
0 |
|
|
358256 |
127295801 |
1 |
SO3N4C15H28 |
AB3C4D15E28 |
-139.52 |
5.11 |
-8.74 |
0.18 |
0 |
|
|
358257 |
127295802 |
1 |
SN3O4C13H25 |
AB3C4D13E25 |
-182.15 |
7.16 |
-9.13 |
0.14 |
0 |
|
|
358258 |
127295803 |
1 |
SO3N5C14H21 |
AB3C5D14E21 |
-102.67 |
3.13 |
-9.25 |
-0.86 |
0 |
|
|
358259 |
127295804 |
1 |
O2N4C19H34 |
A2B4C19D34 |
-119.99 |
5.13 |
-8.74 |
1.18 |
0 |