List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
30123 |
840156 |
1 |
NO3C11H21 |
AB3C11D21 |
-157.07 |
2.97 |
-8.99 |
1.91 |
0 |
|
|
30124 |
840164 |
1 |
NO2H11C12 |
AB2C11D12 |
4.41 |
5.12 |
-8.95 |
-0.88 |
0 |
|
|
30125 |
840182 |
1 |
OS2N3H9C10 |
AB2C3D9E10 |
48.86 |
2.71 |
-9.31 |
-1.25 |
0 |
|
|
30126 |
840186 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-18.29 |
5.12 |
-8.73 |
0.13 |
0 |
|
|
30127 |
840200 |
1 |
N2Cl3O3C11H13 |
A2B3C3D11E13 |
-103.6 |
3.6 |
-9.3 |
-0.78 |
0 |
|
|
30128 |
840204 |
1 |
NO6C15H17 |
AB6C15D17 |
-235.15 |
3.4 |
-9.34 |
-1.22 |
0 |
|
|
30129 |
840205 |
1 |
FNOSCl3H9C10 |
ABCDE3F9G10 |
-82.67 |
2.78 |
-9.39 |
-0.95 |
0 |
|
|
30130 |
840207 |
1 |
FNOSCl3H9C10 |
ABCDE3F9G10 |
-83.42 |
0.9 |
-9.41 |
-0.92 |
0 |
|
|
30131 |
840210 |
1 |
ClO3N4C12H15 |
AB3C4D12E15 |
-9.32 |
8.84 |
-9.17 |
-1.59 |
0 |
|
|
30132 |
840211 |
1 |
FON2Cl4H9C10 |
ABC2D4E9F10 |
-98.09 |
3.01 |
-8.92 |
-0.81 |
0 |
|
|
30133 |
840219 |
2 |
NOC5H5 |
ABC5D5 |
-62.17 |
3.19 |
-9.05 |
-0.29 |
0 |
|
|
30134 |
840227 |
1 |
OSN2C17H18 |
ABC2D17E18 |
33.07 |
3.39 |
-8.7 |
-0.94 |
0 |
|
|
30135 |
840228 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-5.3 |
4.16 |
-8.79 |
-0.51 |
0 |
|
|
30136 |
840245 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-104.34 |
5.5 |
-8.52 |
-0.4 |
0 |
|
|
30137 |
840247 |
1 |
OS2N3C14H19 |
AB2C3D14E19 |
-24.97 |
2.06 |
-8.47 |
-0.76 |
0 |
|
|
30138 |
840250 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-51.41 |
3.87 |
-8.58 |
-1.11 |
0 |
|
|
30139 |
840263 |
1 |
NO2H17C18 |
AB2C17D18 |
-21.03 |
6.59 |
-9.03 |
-0.56 |
0 |
|
|
30140 |
840271 |
1 |
ClN2O3H15C16 |
AB2C3D15E16 |
-87.79 |
6.66 |
-9.19 |
-0.78 |
0 |
|
|
30141 |
840282 |
1 |
NO2C18H21 |
AB2C18D21 |
-61.47 |
2.76 |
-8.48 |
0.03 |
0 |
|
|
30142 |
840283 |
1 |
NO2C18H21 |
AB2C18D21 |
-61.56 |
1.6 |
-8.56 |
0.08 |
0 |
|
|
30143 |
840295 |
1 |
ClNO2C16H16 |
ABC2D16E16 |
-51.8 |
1.24 |
-9.03 |
-0.37 |
0 |
|
|
30144 |
840296 |
1 |
ClNO2C16H16 |
ABC2D16E16 |
-51.42 |
1.12 |
-9.02 |
-0.34 |
0 |
|
|
30145 |
840305 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-36.49 |
8.21 |
-9.24 |
-0.59 |
0 |
|
|
30146 |
840313 |
1 |
FOSN3H8C11 |
ABCD3E8F11 |
8.34 |
2.37 |
-9.66 |
-1.35 |
0 |
|
|
30147 |
840319 |
1 |
NS2C8H13 |
AB2C8D13 |
16.92 |
2.64 |
-8.66 |
-0.45 |
0 |
|
|
30148 |
840320 |
1 |
N3O3H11C13 |
A3B3C11D13 |
8.89 |
4.91 |
-9.09 |
-1.63 |
0 |
|
|
30149 |
840322 |
1 |
ON2S2H16C17 |
AB2C2D16E17 |
39.94 |
3.17 |
-8.57 |
-1.22 |
0 |
|
|
30150 |
840323 |
1 |
NSBr2H7C11 |
ABC2D7E11 |
90.68 |
2.51 |
-9.21 |
-1.32 |
0 |
|
|
30151 |
840324 |
1 |
NO4C17H19 |
AB4C17D19 |
-137.98 |
8.6 |
-8.72 |
-0.28 |
0 |
|
|
30152 |
840329 |
1 |
NCl2O2H7C9 |
AB2C2D7E9 |
17.94 |
5.19 |
-10.52 |
-1.49 |
0 |
|
|
30153 |
840334 |
1 |
ClNSH6C11 |
ABCD6E11 |
62.05 |
2.35 |
-8.66 |
-1.85 |
0 |
|
|
30154 |
840335 |
1 |
ClON2H9C11 |
ABC2D9E11 |
25.71 |
2.66 |
-9.3 |
-1.06 |
0 |
|
|
30155 |
840341 |
1 |
OSN2H16C18 |
ABC2D16E18 |
32.49 |
2.88 |
-9.05 |
-0.84 |
0 |
|
|
30156 |
840342 |
2 |
NOF3C5H6 |
ABC3D5E6 |
-414.12 |
6.82 |
-10.63 |
-0.4 |
0 |
|
|
30157 |
840345 |
1 |
SN4H10C13 |
AB4C10D13 |
116.6 |
5.28 |
-8.85 |
-1.42 |
0 |
|
|
30158 |
840358 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-36.19 |
6.97 |
-8.59 |
-1.19 |
0 |
|
|
30159 |
840379 |
1 |
N2O2C19H22 |
A2B2C19D22 |
-31.21 |
8.06 |
-8.91 |
-0.01 |
0 |
|
|
30160 |
840383 |
1 |
BrO2N4C10H13 |
AB2C4D10E13 |
-76.84 |
4.24 |
-9.25 |
-0.97 |
0 |
|
|
30161 |
840400 |
1 |
SN4O4C11H14 |
AB4C4D11E14 |
-148.86 |
4.1 |
-9.37 |
-1.23 |
0 |
|
|
30162 |
840403 |
1 |
SO2N4C9H12 |
AB2C4D9E12 |
-65.69 |
2.44 |
-8.51 |
-1.0 |
0 |
|
|
30163 |
840405 |
1 |
ClON2S2H7C10 |
ABC2D2E7F10 |
56.62 |
5.27 |
-8.95 |
-1.27 |
0 |
|
|
30164 |
840408 |
2 |
NO2H4C5 |
AB2C4D5 |
-53.66 |
3.17 |
-10.82 |
-2.35 |
0 |
|
|
30165 |
840411 |
1 |
N2O6H8C11 |
A2B6C8D11 |
-129.85 |
7.0 |
-11.07 |
-2.27 |
0 |
|
|
30166 |
840415 |
1 |
ClNO4H8C11 |
ABC4D8E11 |
-142.78 |
6.77 |
-10.53 |
-2.14 |
0 |
|
|
30167 |
840418 |
2 |
NO3H5C6 |
AB3C5D6 |
-134.61 |
7.33 |
-10.71 |
-2.44 |
0 |
|
|
30168 |
840419 |
2 |
NO3H5C6 |
AB3C5D6 |
-134.51 |
7.98 |
-10.72 |
-2.44 |
0 |
|
|
30169 |
840426 |
2 |
NO3C5H5 |
AB3C5D5 |
-95.3 |
6.63 |
-9.43 |
-1.31 |
0 |
|
|
30170 |
840427 |
2 |
NOC6H10 |
ABC6D10 |
-102.44 |
2.08 |
-8.49 |
0.79 |
0 |
|
|
30171 |
840428 |
1 |
ClSN2O2C15H15 |
ABC2D2E15F15 |
-19.0 |
4.17 |
-9.13 |
-0.68 |
0 |
|
|
30172 |
840429 |
1 |
FSCl2N2O2H9C13 |
ABC2D2E2F9G13 |
-58.82 |
4.42 |
-9.43 |
-0.99 |
0 |