List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
52258 |
12015067 |
1 |
FO2C17H23 |
AB2C17D23 |
-129.23 |
3.19 |
-10.08 |
-0.61 |
0 |
|
|
52259 |
12015068 |
1 |
F2O2C17H22 |
A2B2C17D22 |
-182.32 |
2.41 |
-10.17 |
-0.73 |
0 |
|
|
52260 |
12015070 |
1 |
O2F3C13H21 |
A2B3C13D21 |
-281.35 |
3.09 |
-11.1 |
-0.2 |
0 |
|
|
52261 |
12015072 |
1 |
F3O3C13H21 |
A3B3C13D21 |
-309.91 |
2.19 |
-10.27 |
-0.41 |
0 |
|
|
52262 |
12015073 |
1 |
F3O3H17C19 |
A3B3C17D19 |
-219.42 |
2.94 |
-9.51 |
-0.78 |
0 |
|
|
52263 |
12015074 |
1 |
O2F5C18H21 |
A2B5C18D21 |
-337.57 |
4.41 |
-10.23 |
-0.81 |
0 |
|
|
52264 |
12015075 |
1 |
O2F7C19H21 |
A2B7C19D21 |
-436.12 |
3.84 |
-10.23 |
-0.82 |
0 |
|
|
52265 |
12015076 |
1 |
SF3O3C11H19 |
AB3C3D11E19 |
-307.19 |
5.24 |
-10.42 |
-0.35 |
0 |
|
|
52266 |
12015077 |
1 |
O2F3C17H21 |
A2B3C17D21 |
-240.74 |
4.4 |
-10.24 |
-0.83 |
0 |
|
|
52267 |
12015078 |
1 |
F2O3C14H24 |
A2B3C14D24 |
-254.29 |
3.44 |
-9.98 |
0.25 |
0 |
|
|
52268 |
12015079 |
1 |
F3O3C14H23 |
A3B3C14D23 |
-307.81 |
3.14 |
-10.0 |
0.2 |
0 |
|
|
52269 |
12015081 |
1 |
BrNC14H20 |
ABC14D20 |
1.91 |
3.45 |
-8.73 |
-0.48 |
0 |
|
|
52270 |
12015082 |
2 |
NOC7H10 |
ABC7D10 |
-5.51 |
5.82 |
-9.01 |
-0.36 |
0 |
|
|
52271 |
12015083 |
2 |
O2C9H11 |
A2B9C11 |
-164.59 |
3.45 |
-9.75 |
-0.42 |
0 |
|
|
52272 |
12015084 |
4 |
OC5H5 |
AB5C5 |
-121.04 |
2.64 |
-9.81 |
-0.88 |
0 |
|
|
52273 |
12015086 |
1 |
O4C21H22 |
A4B21C22 |
-131.52 |
3.79 |
-9.6 |
-0.29 |
0 |
|
|
52274 |
12015087 |
1 |
NS2H13C15 |
AB2C13D15 |
96.87 |
6.17 |
-8.54 |
-1.64 |
0 |
|
|
52275 |
12015088 |
1 |
NOS2C13H15 |
ABC2D13E15 |
17.02 |
5.08 |
-8.63 |
-1.66 |
0 |
|
|
52276 |
12015089 |
2 |
NO2C6H6 |
AB2C6D6 |
-68.15 |
5.53 |
-10.3 |
-1.38 |
0 |
|
|
52277 |
12015091 |
2 |
NO2C7H8 |
AB2C7D8 |
-69.81 |
6.52 |
-10.27 |
-1.33 |
0 |
|
|
52278 |
12015093 |
1 |
ON2C17H20 |
AB2C17D20 |
13.73 |
1.41 |
-8.69 |
0.1 |
0 |
|
|
52279 |
12015097 |
2 |
PN3O4C26H33 |
AB3C4D26E33 |
-319.0 |
7.93 |
-7.95 |
-0.6 |
0 |
|
|
52281 |
12015099 |
1 |
FNO4C19H20 |
ABC4D19E20 |
-193.68 |
1.04 |
-9.86 |
-0.78 |
0 |
|
|
52282 |
12015100 |
1 |
NO5C19H21 |
AB5C19D21 |
-191.19 |
1.74 |
-9.23 |
-0.72 |
0 |
|
|
52283 |
12015101 |
1 |
NO6C19H21 |
AB6C19D21 |
-210.19 |
12.24 |
-7.8 |
-1.35 |
0 |
|
|
52284 |
12015102 |
1 |
O4C11H14 |
A4B11C14 |
-142.87 |
1.74 |
-9.62 |
0.01 |
0 |
|
|
52285 |
12015103 |
1 |
ClPO4H22C25 |
ABC4D22E25 |
58.78 |
12.12 |
-9.84 |
-2.36 |
0 |
|
|
52286 |
12015105 |
1 |
N2S2O4C11H12 |
A2B2C4D11E12 |
-137.26 |
4.37 |
-9.16 |
-0.91 |
0 |
|
|
52287 |
12015106 |
1 |
ClN2S2O4C11H11 |
AB2C2D4E11F11 |
-148.47 |
2.28 |
-9.26 |
-0.92 |
0 |
|
|
52288 |
12015107 |
1 |
ClN2S2O4C11H11 |
AB2C2D4E11F11 |
-152.02 |
2.98 |
-9.14 |
-1.0 |
0 |
|
|
52289 |
12015109 |
1 |
SN2O2C10H10 |
AB2C2D10E10 |
-49.91 |
4.72 |
-8.96 |
-0.61 |
0 |
|
|
52290 |
12015110 |
1 |
ClSN2O2H9C10 |
ABC2D2E9F10 |
-60.04 |
5.21 |
-9.16 |
-0.88 |
0 |
|
|
52291 |
12015113 |
1 |
BrFPH21C25 |
ABCD21E25 |
33.95 |
4.04 |
-8.72 |
-0.17 |
0 |
|
|
52292 |
12015114 |
1 |
BrPF2H20C25 |
ABC2D20E25 |
-9.27 |
5.01 |
-8.7 |
-0.49 |
0 |
|
|
52293 |
12015115 |
1 |
BrClPH21C25 |
ABCD21E25 |
71.4 |
3.76 |
-8.75 |
-0.22 |
0 |
|
|
52294 |
12015117 |
1 |
S2H10C11 |
A2B10C11 |
78.81 |
1.5 |
-8.98 |
-0.32 |
0 |
|
|
52295 |
12015118 |
1 |
OS2C10H12 |
AB2C10D12 |
-3.22 |
4.05 |
-8.55 |
0.06 |
0 |
|
|
52296 |
12015121 |
1 |
OS2C7H14 |
AB2C7D14 |
-46.82 |
3.82 |
-8.46 |
0.35 |
0 |
|
|
52297 |
12015122 |
1 |
NOC8H11 |
ABC8D11 |
11.14 |
2.31 |
-10.46 |
-0.38 |
0 |
|
|
52298 |
12015123 |
1 |
NOC12H17 |
ABC12D17 |
-23.24 |
4.04 |
-10.17 |
-0.4 |
0 |
|
|
52299 |
12015124 |
1 |
NOC14H21 |
ABC14D21 |
-38.31 |
3.9 |
-9.88 |
-0.32 |
0 |
|
|
52300 |
12015126 |
1 |
OSiC18H22 |
ABC18D22 |
-11.32 |
1.9 |
-9.02 |
0.06 |
0 |
|
|
52301 |
12015127 |
1 |
OSiC12H26 |
ABC12D26 |
-120.0 |
1.21 |
-8.85 |
1.04 |
0 |
|
|
52302 |
12015128 |
1 |
OS2C11H14 |
AB2C11D14 |
-6.55 |
5.1 |
-8.25 |
0.08 |
0 |
|
|
52303 |
12015129 |
1 |
OS2C12H16 |
AB2C12D16 |
-11.7 |
4.93 |
-8.33 |
0.24 |
0 |
|
|
52304 |
12015130 |
1 |
OS2C12H12 |
AB2C12D12 |
48.57 |
5.09 |
-8.42 |
-0.45 |
0 |
|
|
52305 |
12015131 |
1 |
OS2C8H16 |
AB2C8D16 |
-47.89 |
5.35 |
-8.19 |
0.5 |
0 |
|
|
52307 |
12015134 |
2 |
NOH23C30 |
ABC23D30 |
159.12 |
3.98 |
-8.11 |
-1.45 |
0 |
|
|
52308 |
12015135 |
1 |
ON2C17H30 |
AB2C17D30 |
-58.67 |
2.13 |
-8.8 |
0.53 |
0 |
|
|
52309 |
12015136 |
1 |
NOC12H19 |
ABC12D19 |
-49.67 |
2.84 |
-10.09 |
0.49 |
0 |