List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
21146 |
587339 |
1 |
ClO3H9C14 |
AB3C9D14 |
-62.12 |
6.24 |
-9.72 |
-1.21 |
0 |
|
|
21147 |
587340 |
1 |
ClOSN2H9C14 |
ABCD2E9F14 |
32.14 |
4.05 |
-9.11 |
-0.94 |
0 |
|
|
21148 |
587341 |
1 |
ClO2N3H14C20 |
AB2C3D14E20 |
50.8 |
2.12 |
-9.22 |
-1.11 |
0 |
|
|
21149 |
587342 |
1 |
ClN2F3O3C20H20 |
AB2C3D3E20F20 |
-255.09 |
5.87 |
-8.82 |
-0.75 |
0 |
|
|
21150 |
587345 |
1 |
ClNSO4H16C18 |
ABCD4E16F18 |
-131.75 |
7.56 |
-8.95 |
-1.38 |
0 |
|
|
21151 |
587350 |
1 |
Cl2N2O2C19H20 |
A2B2C2D19E20 |
-70.45 |
1.1 |
-9.86 |
-0.71 |
0 |
|
|
21152 |
587352 |
1 |
ClNOH8C10 |
ABCD8E10 |
1.85 |
2.8 |
-10.15 |
-1.23 |
0 |
|
|
21153 |
587355 |
1 |
ClIO2H8C13 |
ABC2D8E13 |
-20.48 |
2.25 |
-9.3 |
-1.29 |
0 |
|
|
21154 |
587357 |
1 |
ClNOH12C14 |
ABCD12E14 |
3.31 |
3.82 |
-9.03 |
-0.51 |
0 |
|
|
21155 |
587358 |
1 |
ClNBr2O2H8C16 |
ABC2D2E8F16 |
3.37 |
2.48 |
-9.43 |
-1.4 |
0 |
|
|
21156 |
587359 |
1 |
NCl2O3H11C15 |
AB2C3D11E15 |
-36.14 |
5.16 |
-9.93 |
-1.76 |
0 |
|
|
21157 |
587361 |
1 |
ClO3H13C17 |
AB3C13D17 |
-65.9 |
4.73 |
-9.59 |
-1.4 |
0 |
|
|
21158 |
587364 |
1 |
ClINOH13C15 |
ABCDE13F15 |
-0.13 |
3.76 |
-9.11 |
-0.88 |
0 |
|
|
21159 |
587366 |
1 |
BrClN2O2H14C16 |
ABC2D2E14F16 |
-11.62 |
3.68 |
-8.71 |
-0.81 |
0 |
|
|
21160 |
587371 |
1 |
ClNO2H8C11 |
ABC2D8E11 |
-28.25 |
3.05 |
-9.56 |
-1.43 |
0 |
|
|
21161 |
587372 |
1 |
ClNBr2O3H12C15 |
ABC2D3E12F15 |
-49.1 |
3.16 |
-10.27 |
-1.59 |
0 |
|
|
21162 |
587374 |
1 |
ClNOC11H14 |
ABCD11E14 |
-46.64 |
3.52 |
-9.78 |
-0.58 |
0 |
|
|
21163 |
587377 |
1 |
ClON2S2F3H10C19 |
ABC2D2E3F10G19 |
-93.56 |
5.59 |
-8.96 |
-1.44 |
0 |
|
|
21164 |
587398 |
1 |
ClNO2S2H10C17 |
ABC2D2E10F17 |
15.86 |
4.73 |
-8.95 |
-1.54 |
0 |
|
|
21165 |
587399 |
1 |
ClO3H11C15 |
AB3C11D15 |
-74.72 |
1.81 |
-9.75 |
-0.92 |
0 |
|
|
21166 |
587401 |
1 |
NCl2O4H9C15 |
AB2C4D9E15 |
-120.14 |
3.32 |
-9.37 |
-1.34 |
0 |
|
|
21167 |
587402 |
1 |
ClO2H13C16 |
AB2C13D16 |
-31.42 |
1.63 |
-9.46 |
-0.97 |
0 |
|
|
21168 |
587411 |
1 |
ClNO3H14C17 |
ABC3D14E17 |
-38.72 |
2.16 |
-8.85 |
-0.97 |
0 |
|
|
21169 |
587412 |
1 |
Cl2C11H18 |
A2B11C18 |
-30.02 |
2.99 |
-9.78 |
0.23 |
0 |
|
|
21170 |
587418 |
1 |
ClNO3C11H12 |
ABC3D11E12 |
-118.9 |
4.26 |
-9.93 |
-0.82 |
0 |
|
|
21171 |
587420 |
2 |
ClC4H4 |
AB4C4 |
-6.13 |
3.11 |
-9.59 |
-0.48 |
0 |
|
|
21172 |
587432 |
1 |
ClOF3H8C14 |
ABC3D8E14 |
-153.23 |
2.16 |
-10.1 |
-1.39 |
0 |
|
|
21173 |
587438 |
1 |
FNCl2O2H12C20 |
ABC2D2E12F20 |
-60.0 |
2.23 |
-9.71 |
-1.13 |
0 |
|
|
21174 |
587447 |
1 |
ClN2O2H5C8 |
AB2C2D5E8 |
58.96 |
2.63 |
-9.74 |
-1.29 |
0 |
|
|
21175 |
587458 |
1 |
ClOC12H15 |
ABC12D15 |
-46.91 |
2.68 |
-9.89 |
-0.87 |
0 |
|
|
21176 |
587462 |
1 |
OSN2C6H8 |
ABC2D6E8 |
26.16 |
2.12 |
-8.59 |
-0.5 |
0 |
|
|
21177 |
587466 |
1 |
ClO2C20H31 |
AB2C20D31 |
-132.08 |
1.93 |
-9.97 |
-0.93 |
0 |
|
|
21178 |
587469 |
1 |
ClO2C15H21 |
AB2C15D21 |
-108.35 |
3.5 |
-9.74 |
-0.74 |
0 |
|
|
21179 |
587471 |
1 |
O2Cl3N3H14C17 |
A2B3C3D14E17 |
-38.94 |
2.92 |
-9.14 |
-0.7 |
0 |
|
|
21180 |
587474 |
1 |
ClSF3N3O3H17C20 |
ABC3D3E3F17G20 |
-210.03 |
7.3 |
-8.87 |
-1.02 |
0 |
|
|
21181 |
587479 |
1 |
N4O5H12C13 |
A4B5C12D13 |
-77.34 |
3.07 |
-9.57 |
-1.42 |
0 |
|
|
21182 |
587480 |
1 |
O9C18H22 |
A9B18C22 |
-332.26 |
4.46 |
-11.01 |
-1.52 |
0 |
|
|
21183 |
587484 |
3 |
OC3H4 |
AB3C4 |
-129.35 |
2.07 |
-9.84 |
-0.44 |
0 |
|
|
21184 |
587485 |
1 |
SC10H16 |
AB10C16 |
-11.41 |
0.16 |
-8.92 |
0.18 |
0 |
|
|
21185 |
587486 |
2 |
NO2H4C6 |
AB2C4D6 |
37.9 |
9.36 |
-9.78 |
-2.03 |
0 |
|
|
21186 |
587546 |
1 |
NO5H7C14 |
AB5C7D14 |
-19.76 |
7.16 |
-10.29 |
-2.22 |
0 |
|
|
21187 |
587552 |
1 |
ClON2H19C24 |
ABC2D19E24 |
84.4 |
2.63 |
-9.0 |
-0.78 |
0 |
|
|
21188 |
587555 |
1 |
NS2H19C23 |
AB2C19D23 |
89.35 |
0.59 |
-8.06 |
-1.02 |
0 |
|
|
21189 |
587576 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-164.65 |
3.74 |
-9.18 |
-0.25 |
0 |
|
|
21190 |
587581 |
2 |
OC15H24 |
AB15C24 |
-157.43 |
5.88 |
-9.72 |
0.43 |
0 |
|
|
21191 |
587584 |
1 |
ClNO2H14C15 |
ABC2D14E15 |
-61.81 |
4.26 |
-8.37 |
-0.78 |
0 |
|
|
21192 |
587593 |
1 |
SF2O5C11H12 |
AB2C5D11E12 |
-276.39 |
5.25 |
-8.94 |
-1.08 |
0 |
|
|
21193 |
587595 |
1 |
O4C27H42 |
A4B27C42 |
-188.32 |
6.57 |
-8.4 |
0.13 |
0 |
|
|
21194 |
587596 |
1 |
ClN2O2H11C16 |
AB2C2D11E16 |
-15.5 |
3.7 |
-9.28 |
-1.14 |
0 |
|
|
21195 |
587602 |
1 |
NOS3H11C14 |
ABC3D11E14 |
38.8 |
3.9 |
-8.81 |
-1.39 |
0 |