List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
319114 |
126654922 |
1 |
ClS2O7N9C52H58 |
AB2C7D9E52F58 |
-149.19 |
7.35 |
-8.32 |
-1.45 |
0 |
|
|
319115 |
126654940 |
1 |
S2N5O9C59H71 |
A2B5C9D59E71 |
-278.98 |
6.44 |
-7.92 |
-0.44 |
0 |
|
|
319116 |
126654943 |
1 |
ClFS2O6N8C55H62 |
ABC2D6E8F55G62 |
-200.93 |
5.74 |
-8.95 |
-1.4 |
0 |
|
|
319117 |
126654950 |
1 |
ClS2O7N8C54H57 |
AB2C7D8E54F57 |
-134.97 |
12.33 |
-8.77 |
-1.54 |
0 |
|
|
319119 |
126654961 |
1 |
SN6O8C55H62 |
AB6C8D55E62 |
-219.39 |
10.14 |
-8.31 |
-0.9 |
0 |
|
|
319122 |
126654983 |
1 |
ClS2N6O6C57H61 |
AB2C6D6E57F61 |
-116.32 |
9.34 |
-8.73 |
-1.08 |
0 |
|
|
319125 |
126655001 |
1 |
ClSO5N9C56H64 |
ABC5D9E56F64 |
-103.85 |
11.86 |
-8.43 |
-1.33 |
0 |
|
|
319126 |
126655004 |
1 |
ClS2O4N10C53H57 |
AB2C4D10E53F57 |
8.49 |
7.86 |
-8.78 |
-1.34 |
0 |
|
|
319128 |
126655010 |
1 |
ClS2O4N10C55H59 |
AB2C4D10E55F59 |
14.84 |
5.88 |
-8.72 |
-1.39 |
0 |
|
|
319130 |
126655035 |
1 |
ClSO4N12C54H59 |
ABC4D12E54F59 |
18.4 |
14.09 |
-8.76 |
-1.45 |
0 |
|
|
319131 |
126655046 |
1 |
ClS2O4N12C53H57 |
AB2C4D12E53F57 |
43.78 |
19.57 |
-9.39 |
-1.33 |
0 |
|
|
319133 |
126655066 |
1 |
ClS2O5N10C56H61 |
AB2C5D10E56F61 |
-58.1 |
14.2 |
-8.83 |
-1.68 |
0 |
|
|
319135 |
126655078 |
1 |
PSN2O6C24H33 |
ABC2D6E24F33 |
-262.52 |
8.35 |
-8.69 |
-0.69 |
0 |
|
|
319136 |
126655086 |
1 |
SN2O4C11H12 |
AB2C4D11E12 |
-113.25 |
5.13 |
-8.67 |
-0.46 |
0 |
|
|
319137 |
126655089 |
1 |
BrNOC16H22 |
ABCD16E22 |
-37.43 |
0.59 |
-9.11 |
-0.28 |
0 |
|
|
319139 |
126655096 |
1 |
NO6C14H25 |
AB6C14D25 |
-304.13 |
6.11 |
-10.14 |
0.31 |
0 |
|
|
319140 |
126655106 |
1 |
FSN2O3H17C18 |
ABC2D3E17F18 |
-119.99 |
4.07 |
-8.78 |
-0.84 |
0 |
|
|
319141 |
126655114 |
1 |
ClNSO2H12C16 |
ABCD2E12F16 |
-16.9 |
3.11 |
-9.19 |
-1.0 |
0 |
|
|
319143 |
126655121 |
1 |
BrNC6H8 |
ABC6D8 |
15.31 |
4.23 |
-9.47 |
-0.34 |
0 |
|
|
319144 |
126655124 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-54.69 |
3.25 |
-9.08 |
-0.06 |
0 |
|
|
319146 |
126655168 |
1 |
NO2C10H17 |
AB2C10D17 |
-94.54 |
1.56 |
-9.6 |
0.92 |
0 |
|
|
319151 |
126655182 |
1 |
NO2C9H15 |
AB2C9D15 |
-86.13 |
2.55 |
-9.66 |
0.93 |
0 |
|
|
319152 |
126655186 |
1 |
SN2C9H16 |
AB2C9D16 |
-3.92 |
1.44 |
-8.89 |
-0.01 |
0 |
|
|
319153 |
126655188 |
1 |
NOSC9H15 |
ABCD9E15 |
-47.18 |
1.67 |
-9.11 |
-0.12 |
0 |
|
|
319155 |
126655200 |
1 |
NOC8H17 |
ABC8D17 |
-72.69 |
2.69 |
-8.68 |
2.61 |
0 |
|
|
319156 |
126655203 |
1 |
NO2C8H17 |
AB2C8D17 |
-100.86 |
2.91 |
-8.68 |
1.77 |
0 |
|
|
319157 |
126655205 |
1 |
NO2C10H21 |
AB2C10D21 |
-102.25 |
3.78 |
-8.6 |
1.82 |
0 |
|
|
319161 |
126655231 |
1 |
F2O2N5H15C20 |
A2B2C5D15E20 |
-69.89 |
5.85 |
-8.52 |
-1.37 |
0 |
|
|
319163 |
126655234 |
1 |
F2O3N5H17C21 |
A2B3C5D17E21 |
-99.4 |
6.17 |
-9.39 |
-1.52 |
0 |
|
|
319165 |
126655238 |
1 |
F2O2N5H19C21 |
A2B2C5D19E21 |
-87.18 |
6.35 |
-8.41 |
-1.31 |
0 |
|
|
319166 |
126655240 |
1 |
OF4N5H17C21 |
AB4C5D17E21 |
-148.27 |
6.79 |
-8.57 |
-1.38 |
0 |
|
|
319167 |
126655241 |
1 |
O2N7C26H33 |
A2B7C26D33 |
2.07 |
6.5 |
-8.74 |
-1.23 |
0 |
|
|
319169 |
126655253 |
1 |
SF3O5C18H23 |
AB3C5D18E23 |
-250.12 |
1.54 |
-8.65 |
-1.25 |
0 |
|
|
319170 |
126655254 |
1 |
FO2N6H15C21 |
AB2C6D15E21 |
18.28 |
3.72 |
-8.82 |
-1.33 |
0 |
|
|
319171 |
126655258 |
1 |
FO3N6H21C23 |
AB3C6D21E23 |
-32.96 |
4.39 |
-8.56 |
-1.45 |
0 |
|
|
319172 |
126655262 |
1 |
FO2N6H21C23 |
AB2C6D21E23 |
-1.8 |
2.43 |
-8.4 |
-1.31 |
0 |
|
|
319175 |
126655265 |
1 |
FO2N7H22C24 |
AB2C7D22E24 |
25.64 |
3.97 |
-8.57 |
-1.3 |
0 |
|
|
319176 |
126655266 |
1 |
FO3N5H16C21 |
AB3C5D16E21 |
-30.05 |
3.47 |
-9.59 |
-1.25 |
0 |
|
|
319177 |
126655267 |
1 |
FO2N6H15C20 |
AB2C6D15E20 |
22.2 |
7.04 |
-8.59 |
-1.66 |
0 |
|
|
319178 |
126655268 |
1 |
F2O4N5C25H25 |
A2B4C5D25E25 |
-169.42 |
1.53 |
-8.69 |
-1.37 |
0 |
|
|
319179 |
126655269 |
1 |
ON3C14H17 |
AB3C14D17 |
30.94 |
3.24 |
-8.28 |
-0.05 |
0 |
|
|
319180 |
126655270 |
1 |
F2O4N5C25H25 |
A2B4C5D25E25 |
-188.61 |
3.45 |
-9.72 |
-1.58 |
0 |
|
|
319183 |
126655273 |
2 |
N2C4H7 |
A2B4C7 |
45.32 |
4.18 |
-8.46 |
0.74 |
0 |
|
|
319184 |
126655274 |
1 |
F2O3N6C26H28 |
A2B3C6D26E28 |
-128.14 |
3.39 |
-8.37 |
-1.29 |
0 |
|
|
319185 |
126655275 |
1 |
N4C15H20 |
A4B15C20 |
72.93 |
3.52 |
-8.06 |
-0.05 |
0 |
|
|
319189 |
126655279 |
1 |
F2O4N5C30H33 |
A2B4C5D30E33 |
-187.13 |
2.18 |
-8.53 |
-1.3 |
0 |
|
|
319190 |
126655280 |
1 |
FO4N5H26C27 |
AB4C5D26E27 |
-104.29 |
1.7 |
-9.61 |
-1.55 |
0 |
|
|
319196 |
126655289 |
1 |
FO4N7C31H34 |
AB4C7D31E34 |
-90.28 |
4.48 |
-8.44 |
-1.34 |
0 |
|
|
319197 |
126655290 |
1 |
ON3C8H11 |
AB3C8D11 |
6.99 |
3.45 |
-9.83 |
-0.37 |
0 |
|
|
319198 |
126655291 |
1 |
FO4N6H25C27 |
AB4C6D25E27 |
-78.94 |
3.64 |
-9.66 |
-1.7 |
0 |