List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
213195 |
81063145 |
1 |
ClFNO3C12H13 |
ABCD3E12F13 |
-175.07 |
5.72 |
-9.98 |
-0.99 |
0 |
|
|
213196 |
81063146 |
1 |
SN2O4C13H18 |
AB2C4D13E18 |
-166.04 |
5.12 |
-9.67 |
-1.14 |
0 |
|
|
213197 |
81063148 |
1 |
N2O4C15H20 |
A2B4C15D20 |
-180.93 |
3.17 |
-8.94 |
-0.2 |
0 |
|
|
213198 |
81063149 |
1 |
NS2O3C12H13 |
AB2C3D12E13 |
-93.6 |
4.87 |
-8.92 |
-1.36 |
0 |
|
|
213199 |
81063150 |
1 |
NO4C15H21 |
AB4C15D21 |
-176.11 |
3.79 |
-9.04 |
-0.28 |
0 |
|
|
213200 |
81063151 |
1 |
ClFNO3C12H13 |
ABCD3E12F13 |
-175.78 |
3.78 |
-10.18 |
-1.0 |
0 |
|
|
213201 |
81063152 |
1 |
NO4C15H21 |
AB4C15D21 |
-177.61 |
3.38 |
-9.03 |
0.16 |
0 |
|
|
213202 |
81063155 |
1 |
NF2O4C13H15 |
AB2C4D13E15 |
-268.7 |
2.09 |
-10.04 |
-0.8 |
0 |
|
|
213203 |
81063156 |
1 |
NO3C8H11 |
AB3C8D11 |
-85.1 |
2.99 |
-10.05 |
-0.01 |
0 |
|
|
213204 |
81063157 |
1 |
FNO4C15H16 |
ABC4D15E16 |
-190.25 |
3.42 |
-9.5 |
-1.06 |
0 |
|
|
213205 |
81063158 |
1 |
ClNSO5C13H16 |
ABCD5E13F16 |
-208.1 |
7.6 |
-10.19 |
-1.18 |
0 |
|
|
213206 |
81063160 |
1 |
NO3F4C13H13 |
AB3C4D13E13 |
-327.34 |
4.1 |
-10.28 |
-1.27 |
0 |
|
|
213207 |
81063164 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-78.2 |
4.91 |
-10.06 |
-1.51 |
0 |
|
|
213208 |
81063171 |
1 |
NO4C13H23 |
AB4C13D23 |
-215.69 |
4.61 |
-9.8 |
0.38 |
0 |
|
|
213209 |
81063172 |
1 |
N2O5C14H20 |
A2B5C14D20 |
-195.9 |
5.99 |
-9.72 |
-0.72 |
0 |
|
|
213210 |
81063174 |
1 |
NO4C12H17 |
AB4C12D17 |
-167.33 |
4.69 |
-9.4 |
0.38 |
0 |
|
|
213211 |
81063175 |
1 |
NSO3C14H19 |
ABC3D14E19 |
-131.71 |
4.29 |
-8.97 |
-0.41 |
0 |
|
|
213212 |
81063176 |
1 |
NO3C14H19 |
AB3C14D19 |
-137.93 |
1.63 |
-9.38 |
-0.03 |
0 |
|
|
213213 |
81063179 |
1 |
NO4C16H23 |
AB4C16D23 |
-184.6 |
5.29 |
-9.16 |
0.22 |
0 |
|
|
213214 |
81063180 |
1 |
NO4C15H21 |
AB4C15D21 |
-172.32 |
3.54 |
-9.2 |
-0.02 |
0 |
|
|
213215 |
81063181 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-102.28 |
4.08 |
-8.81 |
-0.48 |
0 |
|
|
213216 |
81063183 |
1 |
NSO3C10H13 |
ABC3D10E13 |
-112.55 |
3.31 |
-9.48 |
-0.68 |
0 |
|
|
213217 |
81063187 |
1 |
NO3C17H25 |
AB3C17D25 |
-148.6 |
3.46 |
-9.63 |
-0.15 |
0 |
|
|
213218 |
81063188 |
1 |
N3O5C13H19 |
A3B5C13D19 |
-222.62 |
4.39 |
-10.12 |
-0.84 |
0 |
|
|
213219 |
81063192 |
1 |
NBr2O4C14H17 |
AB2C4D14E17 |
-156.51 |
3.51 |
-9.49 |
-0.8 |
0 |
|
|
213220 |
81063194 |
1 |
ClNSO3C14H18 |
ABCD3E14F18 |
-133.44 |
5.8 |
-9.21 |
-0.89 |
0 |
|
|
213221 |
81063196 |
1 |
BrFNO3C15H17 |
ABCD3E15F17 |
-155.63 |
3.96 |
-9.88 |
-0.9 |
0 |
|
|
213222 |
81063197 |
1 |
NSCl2O3C14H17 |
ABC2D3E14F17 |
-140.32 |
4.41 |
-8.98 |
-0.89 |
0 |
|
|
213223 |
81063198 |
1 |
NO5C15H21 |
AB5C15D21 |
-197.35 |
3.75 |
-9.06 |
-0.29 |
0 |
|
|
213224 |
81063200 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-126.47 |
4.15 |
-9.18 |
0.13 |
0 |
|
|
213225 |
81063201 |
1 |
ClON2C17H29 |
ABC2D17E29 |
-50.08 |
4.18 |
-8.61 |
-0.09 |
0 |
|
|
213226 |
81063202 |
1 |
ON2C18H32 |
AB2C18D32 |
-47.04 |
2.49 |
-8.55 |
0.43 |
0 |
|
|
213227 |
81063204 |
1 |
ON2C18H38 |
AB2C18D38 |
-98.24 |
1.55 |
-8.39 |
2.27 |
0 |
|
|
213228 |
81063205 |
1 |
O2N5C14H25 |
A2B5C14D25 |
-53.42 |
2.98 |
-9.02 |
-0.85 |
0 |
|
|
213229 |
81063206 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-60.78 |
8.2 |
-9.32 |
-1.4 |
0 |
|
|
213230 |
81063207 |
1 |
ON2C18H32 |
AB2C18D32 |
-45.87 |
2.03 |
-8.58 |
0.46 |
0 |
|
|
213231 |
81063211 |
1 |
ON2C18H32 |
AB2C18D32 |
-38.06 |
2.09 |
-8.4 |
0.4 |
0 |
|
|
213232 |
81063216 |
1 |
ClON2C17H29 |
ABC2D17E29 |
-49.07 |
3.19 |
-8.68 |
-0.09 |
0 |
|
|
213233 |
81063217 |
1 |
NF3O3C14H18 |
AB3C3D14E18 |
-276.73 |
11.12 |
-8.89 |
-0.78 |
0 |
|
|
213234 |
81063218 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-129.65 |
4.99 |
-9.53 |
-0.8 |
0 |
|
|
213235 |
81063225 |
1 |
ON2C18H38 |
AB2C18D38 |
-87.92 |
1.42 |
-8.48 |
2.1 |
0 |
|
|
213236 |
81063227 |
1 |
ON2C18H32 |
AB2C18D32 |
-48.54 |
2.4 |
-8.55 |
0.42 |
0 |
|
|
213237 |
81063230 |
1 |
N2O2C17H36 |
A2B2C17D36 |
-135.8 |
3.11 |
-8.57 |
2.17 |
0 |
|
|
213238 |
81063232 |
1 |
BrON2C17H29 |
ABC2D17E29 |
-41.21 |
3.14 |
-8.67 |
-0.14 |
0 |
|
|
213239 |
81063239 |
1 |
ON2C18H36 |
AB2C18D36 |
-65.02 |
2.8 |
-8.47 |
2.37 |
0 |
|
|
213240 |
81063240 |
1 |
FON2C17H29 |
ABC2D17E29 |
-91.2 |
2.66 |
-8.64 |
-0.06 |
0 |
|
|
213241 |
81063246 |
1 |
ClON2C17H29 |
ABC2D17E29 |
-52.98 |
3.17 |
-8.66 |
-0.09 |
0 |
|
|
213242 |
81063247 |
1 |
ON9C10H17 |
AB9C10D17 |
84.29 |
3.69 |
-9.52 |
-1.03 |
0 |
|
|
213243 |
81063250 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-22.23 |
7.9 |
-8.65 |
-1.13 |
0 |
|
|
213244 |
81063251 |
1 |
ON4C11H20 |
AB4C11D20 |
-10.73 |
3.41 |
-8.32 |
0.3 |
0 |