List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
399134 |
135038076 |
1 |
OH8C9 |
AB8C9 |
63.08 |
2.07 |
-9.46 |
-0.48 |
0 |
|
|
399135 |
135038079 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-44.26 |
3.99 |
-8.49 |
-0.26 |
-1 |
|
|
399136 |
135038093 |
1 |
N2C14H17 |
A2B14C17 |
92.51 |
0.97 |
0.0 |
0.0 |
0 |
|
|
399137 |
135038097 |
1 |
INOF3H11C13 |
ABCD3E11F13 |
-158.8 |
7.04 |
-9.29 |
-1.55 |
1 |
|
|
399138 |
135038102 |
1 |
O3C10H15 |
A3B10C15 |
-130.76 |
4.07 |
0.0 |
0.0 |
0 |
|
|
399139 |
135038114 |
1 |
NOC16H25 |
ABC16D25 |
-62.61 |
2.53 |
-9.62 |
-0.02 |
0 |
|
|
399140 |
135038115 |
1 |
NO3C11H21 |
AB3C11D21 |
-163.19 |
3.09 |
-9.41 |
0.77 |
1 |
|
|
399141 |
135038166 |
1 |
OC10H17 |
AB10C17 |
-41.07 |
2.03 |
0.0 |
0.0 |
0 |
|
|
399142 |
135038178 |
1 |
BrNOC15H16 |
ABCD15E16 |
-9.53 |
1.46 |
-8.06 |
-0.18 |
0 |
|
|
399143 |
135038179 |
1 |
SiO3C16H24 |
AB3C16D24 |
-153.97 |
4.81 |
-9.39 |
-0.13 |
0 |
|
|
399144 |
135038191 |
1 |
OC13H16 |
AB13C16 |
-14.47 |
3.39 |
-9.07 |
0.12 |
0 |
|
|
399146 |
135038221 |
1 |
N2O3C13H16 |
A2B3C13D16 |
-85.73 |
8.61 |
-9.52 |
-0.89 |
0 |
|
|
399147 |
135038223 |
1 |
ClNSO4H10C11 |
ABCD4E10F11 |
-140.09 |
8.83 |
-10.82 |
-1.8 |
0 |
|
|
399148 |
135038235 |
1 |
NOC12H19 |
ABC12D19 |
-28.63 |
3.95 |
-9.67 |
0.78 |
0 |
|
|
399149 |
135038239 |
2 |
SeC8H8 |
AB8C8 |
57.09 |
0.89 |
-8.46 |
-0.47 |
0 |
|
|
399151 |
135038293 |
1 |
O6C13H26 |
A6B13C26 |
-316.71 |
5.02 |
-10.0 |
0.8 |
0 |
|
|
399152 |
135038308 |
1 |
INOC15H16 |
ABCD15E16 |
20.78 |
5.78 |
-8.64 |
-0.76 |
0 |
|
|
399154 |
135038324 |
1 |
NOC11H13 |
ABC11D13 |
-1.93 |
3.93 |
-9.4 |
-0.02 |
0 |
|
|
399155 |
135038338 |
1 |
ClN2H13C15 |
AB2C13D15 |
62.83 |
4.66 |
-7.92 |
-1.05 |
0 |
|
|
399156 |
135038341 |
1 |
OC18H18 |
AB18C18 |
-10.14 |
4.27 |
-9.28 |
-0.51 |
0 |
|
|
399157 |
135038349 |
1 |
NOC17H19 |
ABC17D19 |
-17.36 |
4.69 |
-8.78 |
0.02 |
1 |
|
|
399158 |
135038368 |
1 |
SiN3O3C11H28 |
AB3C3D11E28 |
-177.25 |
6.07 |
0.0 |
0.0 |
0 |
|
|
399159 |
135038371 |
1 |
NOC11H15 |
ABC11D15 |
-18.86 |
0.69 |
-9.66 |
0.04 |
0 |
|
|
399160 |
135038374 |
1 |
O3C13H18 |
A3B13C18 |
-133.67 |
0.89 |
-9.43 |
0.34 |
0 |
|
|
399161 |
135038376 |
1 |
NO3H11C12 |
AB3C11D12 |
-32.63 |
4.86 |
-8.3 |
-1.88 |
0 |
|
|
399162 |
135038378 |
2 |
O2C7H8 |
A2B7C8 |
-115.31 |
2.8 |
-9.36 |
-0.68 |
0 |
|
|
399163 |
135038386 |
1 |
OS2C8H10 |
AB2C8D10 |
4.54 |
2.57 |
-8.53 |
-0.44 |
0 |
|
|
399164 |
135038396 |
1 |
SO3H14C16 |
AB3C14D16 |
-52.65 |
3.87 |
-9.54 |
-0.94 |
0 |
|
|
399165 |
135038398 |
1 |
SeTeC12H20 |
ABC12D20 |
-12.38 |
1.3 |
-8.02 |
-0.08 |
1 |
|
|
399166 |
135038399 |
1 |
INOC13H17 |
ABCD13E17 |
-9.93 |
3.43 |
0.0 |
0.0 |
0 |
|
|
399167 |
135038416 |
1 |
OS2C8H10 |
AB2C8D10 |
0.25 |
6.44 |
-8.8 |
-1.05 |
0 |
|
|
399169 |
135038421 |
1 |
NO4C11H21 |
AB4C11D21 |
-185.1 |
3.89 |
-9.82 |
0.79 |
0 |
|
|
399170 |
135038434 |
1 |
C13H18 |
A13B18 |
40.42 |
1.29 |
-8.68 |
0.68 |
0 |
|
|
399171 |
135038435 |
1 |
FSO2C12H15 |
ABC2D12E15 |
-120.44 |
3.43 |
-9.34 |
-0.11 |
0 |
|
|
399172 |
135038441 |
1 |
BrMgNOC6H8 |
ABCDE6F8 |
-82.82 |
5.28 |
-9.56 |
-0.27 |
0 |
|
|
399173 |
135038452 |
2 |
NOC7H8 |
ABC7D8 |
-11.9 |
6.65 |
-10.51 |
-1.04 |
0 |
|
|
399174 |
135038456 |
1 |
OC14H16 |
AB14C16 |
37.23 |
4.24 |
-9.43 |
-0.6 |
0 |
|
|
399175 |
135038464 |
1 |
S2O3H10C13 |
A2B3C10D13 |
-60.85 |
3.47 |
-9.22 |
-1.21 |
0 |
|
|
399176 |
135038466 |
1 |
NO3C16H19 |
AB3C16D19 |
-110.33 |
2.33 |
-9.73 |
-0.2 |
-1 |
|
|
399177 |
135038490 |
1 |
ZnO3C9H9 |
AB3C9D9 |
-165.28 |
17.59 |
0.0 |
0.0 |
0 |
|
|
399178 |
135038497 |
1 |
FO2H15C16 |
AB2C15D16 |
-99.31 |
2.63 |
-8.79 |
-0.12 |
0 |
|
|
399179 |
135038504 |
1 |
SSiC11H24 |
ABC11D24 |
-58.75 |
1.63 |
-8.3 |
0.8 |
0 |
|
|
399180 |
135038513 |
1 |
OS2C11H14 |
AB2C11D14 |
-4.06 |
2.54 |
-7.7 |
0.2 |
0 |
|
|
399181 |
135038518 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-143.67 |
3.84 |
-9.65 |
-0.38 |
0 |
|
|
399182 |
135038529 |
2 |
OC7H8 |
AB7C8 |
-33.98 |
2.77 |
-9.03 |
-0.07 |
0 |
|
|
399183 |
135038543 |
2 |
OC8H10 |
AB8C10 |
-53.67 |
4.46 |
-9.32 |
0.06 |
0 |
|
|
399184 |
135038546 |
1 |
PdN2C15H16 |
AB2C15D16 |
155.64 |
4.79 |
-7.25 |
0.26 |
0 |
|
|
399185 |
135038547 |
1 |
SO6C13H20 |
AB6C13D20 |
-266.09 |
6.64 |
-10.19 |
-0.88 |
0 |
|
|
399186 |
135038556 |
1 |
OF2N2H8C12 |
AB2C2D8E12 |
-50.99 |
3.17 |
-9.07 |
-1.87 |
0 |
|
|
399187 |
135038566 |
2 |
OC7H8 |
AB7C8 |
-54.74 |
2.52 |
-9.34 |
-0.5 |
-1 |