List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
332781 |
127251091 |
1 |
ClO2N4H21C22 |
AB2C4D21E22 |
5.65 |
5.6 |
-9.05 |
-0.94 |
0 |
|
|
332782 |
127251092 |
1 |
ClO2N3C16H16 |
AB2C3D16E16 |
-25.55 |
4.15 |
-9.41 |
-1.0 |
0 |
|
|
332783 |
127251093 |
1 |
O3N4H20C22 |
A3B4C20D22 |
-20.94 |
4.02 |
-9.38 |
-1.04 |
0 |
|
|
332784 |
127251094 |
1 |
ClN3O3H20C22 |
AB3C3D20E22 |
-29.4 |
5.69 |
-9.3 |
-1.0 |
0 |
|
|
332785 |
127251209 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-54.63 |
8.83 |
-9.24 |
-0.77 |
0 |
|
|
332786 |
127251210 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-54.74 |
7.71 |
-9.28 |
-0.81 |
0 |
|
|
332787 |
127251211 |
1 |
SO4N5C19H21 |
AB4C5D19E21 |
-49.81 |
6.92 |
-8.76 |
-0.67 |
0 |
|
|
332788 |
127251212 |
1 |
ClSO3N5C18H18 |
ABC3D5E18F18 |
-18.32 |
8.96 |
-9.27 |
-0.94 |
0 |
|
|
332789 |
127251213 |
1 |
SF3N3O3C20H22 |
AB3C3D3E20F22 |
-223.2 |
7.55 |
-9.49 |
-1.03 |
0 |
|
|
332790 |
127251214 |
1 |
FO3N5C20H20 |
AB3C5D20E20 |
-46.28 |
4.92 |
-9.68 |
-1.13 |
0 |
|
|
332791 |
127251215 |
1 |
O4N5C21H23 |
A4B5C21D23 |
-39.08 |
2.47 |
-9.02 |
-0.91 |
0 |
|
|
332792 |
127251216 |
1 |
O4N5C21H23 |
A4B5C21D23 |
-40.42 |
3.01 |
-8.95 |
-0.86 |
0 |
|
|
332793 |
127251217 |
1 |
O4N5C23H27 |
A4B5C23D27 |
-33.92 |
2.74 |
-8.82 |
-0.76 |
0 |
|
|
332794 |
127251218 |
1 |
FO3N5C22H24 |
AB3C5D22E24 |
-70.09 |
2.41 |
-9.52 |
-0.87 |
0 |
|
|
332795 |
127251219 |
1 |
ClO2N5H20C23 |
AB2C5D20E23 |
37.36 |
3.48 |
-8.99 |
-0.97 |
0 |
|
|
332796 |
127251220 |
1 |
FO2N4C25H25 |
AB2C4D25E25 |
-35.24 |
5.44 |
-8.32 |
-0.73 |
0 |
|
|
332797 |
127251221 |
1 |
N6C23H24 |
A6B23C24 |
124.97 |
3.24 |
-8.59 |
-0.52 |
0 |
|
|
332798 |
127251222 |
1 |
FN6C24H25 |
AB6C24D25 |
67.65 |
3.09 |
-8.44 |
-0.3 |
0 |
|
|
332799 |
127251223 |
1 |
ON6C18H20 |
AB6C18D20 |
49.59 |
4.67 |
-8.73 |
-0.67 |
0 |
|
|
332800 |
127251224 |
1 |
ON6H22C23 |
AB6C22D23 |
84.65 |
3.23 |
-8.62 |
-0.62 |
0 |
|
|
332801 |
127251225 |
1 |
ON6C24H24 |
AB6C24D24 |
77.21 |
7.58 |
-8.48 |
-0.53 |
0 |
|
|
332802 |
127251226 |
2 |
ON3C12H12 |
AB3C12D12 |
45.67 |
3.95 |
-8.7 |
-0.69 |
0 |
|
|
332803 |
127251227 |
1 |
O2N6C25H26 |
A2B6C25D26 |
34.56 |
7.07 |
-8.57 |
-0.56 |
0 |
|
|
332804 |
127251228 |
1 |
FO2N5H24C25 |
AB2C5D24E25 |
-11.37 |
5.92 |
-8.73 |
-0.72 |
0 |
|
|
332805 |
127251229 |
2 |
ON3C11H14 |
AB3C11D14 |
-5.69 |
4.74 |
-8.29 |
-0.25 |
0 |
|
|
332806 |
127251230 |
1 |
FON6C21H25 |
ABC6D21E25 |
-15.6 |
5.99 |
-8.51 |
-0.58 |
0 |
|
|
332807 |
127251231 |
1 |
N6C21H28 |
A6B21C28 |
78.43 |
2.01 |
-8.42 |
-0.44 |
0 |
|
|
332808 |
127251232 |
2 |
N3C11H15 |
A3B11C15 |
66.92 |
3.52 |
-8.41 |
-0.31 |
0 |
|
|
332809 |
127251233 |
1 |
O4N5C24H27 |
A4B5C24D27 |
-73.0 |
4.86 |
-8.63 |
-0.62 |
0 |
|
|
332810 |
127251234 |
1 |
ON6C20H24 |
AB6C20D24 |
44.88 |
4.3 |
-8.39 |
-0.49 |
0 |
|
|
332811 |
127251235 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-6.01 |
1.31 |
-8.57 |
-0.68 |
0 |
|
|
332812 |
127251236 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-43.47 |
4.77 |
-8.68 |
-0.71 |
0 |
|
|
332813 |
127251237 |
1 |
ON5C24H29 |
AB5C24D29 |
27.89 |
6.15 |
-8.62 |
-0.65 |
0 |
|
|
332814 |
127251238 |
1 |
ON6C24H30 |
AB6C24D30 |
29.94 |
1.94 |
-8.61 |
-0.59 |
0 |
|
|
332815 |
127251239 |
2 |
ON3C12H12 |
AB3C12D12 |
48.67 |
2.35 |
-8.58 |
-0.57 |
0 |
|
|
332816 |
127251240 |
1 |
O2N6C25H26 |
A2B6C25D26 |
38.3 |
4.13 |
-8.42 |
-0.47 |
0 |
|
|
332817 |
127251241 |
1 |
FO2N5H24C25 |
AB2C5D24E25 |
-9.25 |
3.99 |
-8.65 |
-0.62 |
0 |
|
|
332818 |
127251242 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-43.6 |
5.83 |
-8.43 |
-0.42 |
0 |
|
|
332819 |
127251243 |
1 |
ON6C19H22 |
AB6C19D22 |
45.29 |
3.75 |
-8.65 |
-0.64 |
0 |
|
|
332820 |
127251244 |
1 |
FON6H21C23 |
ABC6D21E23 |
42.83 |
3.75 |
-8.71 |
-0.69 |
0 |
|
|
332821 |
127251245 |
2 |
ON3C12H12 |
AB3C12D12 |
51.1 |
4.95 |
-8.12 |
-0.54 |
0 |
|
|
332822 |
127251246 |
1 |
FO2N5C20H22 |
AB2C5D20E22 |
-37.52 |
4.49 |
-8.7 |
-0.73 |
0 |
|
|
332823 |
127251247 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-29.31 |
4.74 |
-8.59 |
-0.7 |
0 |
|
|
332824 |
127251248 |
1 |
ON6C24H30 |
AB6C24D30 |
31.51 |
4.9 |
-8.69 |
-0.7 |
0 |
|
|
332825 |
127251249 |
1 |
ON6C25H32 |
AB6C25D32 |
20.49 |
5.55 |
-8.49 |
-0.44 |
0 |
|
|
332826 |
127251250 |
1 |
O2N6C25H26 |
A2B6C25D26 |
35.74 |
2.93 |
-8.6 |
-0.57 |
0 |
|
|
332827 |
127251251 |
1 |
O3N5C24H29 |
A3B5C24D29 |
-47.45 |
3.63 |
-8.44 |
-0.56 |
0 |
|
|
332828 |
127251252 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-53.45 |
5.1 |
-8.64 |
-0.71 |
0 |
|
|
332829 |
127251253 |
2 |
ON3C10H12 |
AB3C10D12 |
9.33 |
2.01 |
-8.58 |
-0.56 |
0 |
|
|
332830 |
127251254 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-37.35 |
0.26 |
-8.58 |
-0.68 |
0 |