List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
323262 |
126673901 |
1 |
ClO6C21H25 |
AB6C21D25 |
-248.82 |
1.9 |
-9.1 |
-0.44 |
0 |
|
|
323263 |
126673902 |
4 |
OC9H17 |
AB9C17 |
-270.45 |
5.0 |
-9.68 |
0.26 |
0 |
|
|
323264 |
126673903 |
1 |
FOSN3H12C13 |
ABCD3E12F13 |
14.58 |
6.3 |
-8.63 |
-1.0 |
0 |
|
|
323265 |
126673906 |
1 |
S2N3O4C12H17 |
A2B3C4D12E17 |
-96.13 |
5.7 |
-8.87 |
-1.06 |
0 |
|
|
323266 |
126673907 |
1 |
SN3C5H7 |
AB3C5D7 |
64.19 |
3.9 |
-8.42 |
-0.51 |
0 |
|
|
323267 |
126673909 |
1 |
IN4O4C12H19 |
AB4C4D12E19 |
-126.36 |
5.37 |
-9.9 |
-1.76 |
0 |
|
|
323268 |
126673915 |
2 |
OC16H28 |
AB16C28 |
-140.7 |
5.33 |
-9.14 |
-0.13 |
0 |
|
|
323269 |
126673916 |
2 |
OC20H36 |
AB20C36 |
-170.21 |
5.19 |
-9.82 |
0.1 |
0 |
|
|
323270 |
126673917 |
2 |
OC20H36 |
AB20C36 |
-181.43 |
5.16 |
-9.13 |
-0.11 |
0 |
|
|
323271 |
126673923 |
2 |
O2C17H32 |
A2B17C32 |
-260.45 |
4.11 |
-9.68 |
0.26 |
0 |
|
|
323272 |
126673931 |
2 |
OC22H40 |
AB22C40 |
-190.48 |
5.38 |
-9.82 |
0.1 |
0 |
|
|
323273 |
126673935 |
2 |
OC18H32 |
AB18C32 |
-161.37 |
5.12 |
-9.13 |
-0.11 |
0 |
|
|
323274 |
126673948 |
2 |
OC8H14 |
AB8C14 |
-110.74 |
5.06 |
-9.66 |
0.57 |
0 |
|
|
323275 |
126673955 |
1 |
ON2C14H28 |
AB2C14D28 |
-68.49 |
0.55 |
-9.42 |
1.17 |
0 |
|
|
323276 |
126673960 |
2 |
OC3H8 |
AB3C8 |
-61.5 |
1.42 |
-10.08 |
0.19 |
0 |
|
|
323277 |
126673965 |
1 |
PC6O9H11 |
AB6C9D11 |
-458.9 |
3.54 |
-10.68 |
-0.83 |
0 |
|
|
323278 |
126673967 |
1 |
SP4N7O24C27H47 |
AB4C7D24E27F47 |
-1294.71 |
3.06 |
-8.92 |
-0.58 |
0 |
|
|
323279 |
126673969 |
1 |
O2N3C25H29 |
A2B3C25D29 |
-21.8 |
2.42 |
-8.48 |
-0.56 |
0 |
|
|
323280 |
126673970 |
1 |
ON3C23H27 |
AB3C23D27 |
25.62 |
2.93 |
-9.21 |
-0.89 |
0 |
|
|
323281 |
126673976 |
1 |
PC9O10H15 |
AB9C10D15 |
-520.51 |
2.45 |
-11.09 |
-0.42 |
0 |
|
|
323282 |
126673979 |
1 |
NSO3H15C17 |
ABC3D15E17 |
-9.56 |
4.9 |
-8.42 |
-0.53 |
0 |
|
|
323283 |
126673980 |
1 |
SF2Cl3O3N4H9C11 |
AB2C3D3E4F9G11 |
-185.58 |
2.49 |
-9.04 |
-1.1 |
0 |
|
|
323284 |
126673984 |
1 |
Cl2N2O4C29H30 |
A2B2C4D29E30 |
-69.46 |
3.4 |
-8.79 |
-0.83 |
0 |
|
|
323285 |
126673987 |
1 |
NSO3C12H15 |
ABC3D12E15 |
-112.4 |
3.79 |
-8.63 |
-0.49 |
0 |
|
|
323286 |
126673988 |
1 |
S2F3O4N5C28H32 |
A2B3C4D5E28F32 |
-238.22 |
9.16 |
-9.23 |
-1.17 |
0 |
|
|
323287 |
126673995 |
1 |
F3S3N6O9C32H43 |
A3B3C6D9E32F43 |
-451.39 |
10.17 |
-8.41 |
-0.32 |
0 |
|
|
323288 |
126673997 |
1 |
SF3N3O5C28H28 |
AB3C3D5E28F28 |
-258.57 |
5.84 |
-8.48 |
-0.63 |
0 |
|
|
323289 |
126674011 |
1 |
OF4N4H18C20 |
AB4C4D18E20 |
-158.96 |
1.78 |
-9.15 |
-0.96 |
0 |
|
|
323290 |
126674014 |
1 |
FO2N3H12C14 |
AB2C3D12E14 |
-51.72 |
7.41 |
-9.15 |
-0.72 |
0 |
|
|
323291 |
126674016 |
1 |
ClOF2N4H19C20 |
ABC2D4E19F20 |
-75.6 |
2.93 |
-9.03 |
-0.97 |
0 |
|
|
323292 |
126674027 |
1 |
ClOF2N5C19H22 |
ABC2D5E19F22 |
-94.33 |
7.51 |
-8.72 |
-0.33 |
0 |
|
|
323293 |
126674032 |
1 |
NH63C65 |
AB63C65 |
115.08 |
3.31 |
-7.7 |
-0.42 |
0 |
|
|
323294 |
126674033 |
1 |
N2H80C83 |
A2B80C83 |
159.69 |
1.13 |
-7.86 |
-0.98 |
0 |
|
|
323295 |
126674037 |
2 |
FH22C35 |
AB22C35 |
156.01 |
0.08 |
-8.1 |
-1.06 |
0 |
|
|
323296 |
126674038 |
1 |
N2O2F3H9C15 |
A2B2C3D9E15 |
-143.93 |
5.95 |
-9.51 |
-1.1 |
0 |
|
|
323297 |
126674044 |
1 |
O2F3N3C22H22 |
A2B3C3D22E22 |
-160.6 |
8.64 |
-8.96 |
-0.63 |
0 |
|
|
323298 |
126674045 |
1 |
ClOF4N4H19C20 |
ABC4D4E19F20 |
-200.22 |
4.69 |
-9.39 |
-1.03 |
0 |
|
|
323299 |
126674057 |
1 |
ON3F4H19C21 |
AB3C4D19E21 |
-170.64 |
3.64 |
-8.96 |
-0.88 |
0 |
|
|
323300 |
126674062 |
1 |
OCl2F3N4H19C20 |
AB2C3D4E19F20 |
-154.59 |
5.83 |
-9.15 |
-0.84 |
0 |
|
|
323301 |
126674063 |
1 |
ClOF3N4H18C20 |
ABC3D4E18F20 |
-120.2 |
1.65 |
-9.14 |
-0.94 |
0 |
|
|
323302 |
126674065 |
1 |
OF4N4H18C20 |
AB4C4D18E20 |
-157.54 |
2.97 |
-9.09 |
-1.03 |
0 |
|
|
323303 |
126674068 |
1 |
OCl2F2N4C20H20 |
AB2C2D4E20F20 |
-113.93 |
8.43 |
-9.15 |
-1.03 |
0 |
|
|
323304 |
126674073 |
1 |
OCl2F2N4C20H20 |
AB2C2D4E20F20 |
-108.63 |
7.44 |
-9.07 |
-0.95 |
0 |
|
|
323305 |
126674079 |
1 |
OF2N5C23H23 |
AB2C5D23E23 |
-41.46 |
8.6 |
-9.02 |
-0.77 |
0 |
|
|
323306 |
126674087 |
1 |
O4C13H14 |
A4B13C14 |
-105.22 |
6.81 |
-9.32 |
-0.98 |
0 |
|
|
323307 |
126674088 |
1 |
SC2H6N6 |
AB2C6D6 |
100.01 |
2.17 |
-8.93 |
-0.76 |
0 |
|
|
323308 |
126674089 |
1 |
ClOF3N3C21H21 |
ABC3D3E21F21 |
-161.84 |
8.25 |
-8.88 |
-0.71 |
0 |
|
|
323309 |
126674092 |
1 |
ClOF4N4H19C20 |
ABC4D4E19F20 |
-199.25 |
3.83 |
-9.41 |
-1.03 |
0 |
|
|
323310 |
126674095 |
1 |
ClF2O2N3C22H24 |
AB2C2D3E22F24 |
-149.12 |
7.89 |
-8.94 |
-0.5 |
0 |
|
|
323311 |
126674099 |
2 |
S2C7H10O10 |
A2B7C10D10 |
-797.25 |
5.73 |
-9.29 |
-1.54 |
0 |
|
|
323312 |
126674103 |
1 |
O7C14H20 |
A7B14C20 |
-288.98 |
7.11 |
-9.24 |
-1.13 |
0 |
|
|
323313 |
126674118 |
1 |
ClO2N7C18H24 |
AB2C7D18E24 |
-27.25 |
5.83 |
-8.38 |
-0.29 |
0 |
|
|
323314 |
126674120 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-45.36 |
3.86 |
-8.8 |
0.36 |
0 |
|
|
323315 |
126674122 |
1 |
NSO2H13C14 |
ABC2D13E14 |
-18.0 |
4.87 |
-8.27 |
-1.26 |
0 |
|
|
323316 |
126674129 |
1 |
ClN8C19H21 |
AB8C19D21 |
113.43 |
1.99 |
-8.45 |
-0.78 |
0 |
|
|
323317 |
126674138 |
1 |
BrClO2H10C14 |
ABC2D10E14 |
-19.77 |
2.37 |
-9.24 |
-0.9 |
0 |
|
|
323318 |
126674146 |
1 |
SO4C19H24 |
AB4C19D24 |
-144.32 |
3.01 |
-8.62 |
0.05 |
0 |
|
|
323319 |
126674150 |
2 |
NO2C9H10 |
AB2C9D10 |
-125.94 |
2.25 |
-9.27 |
-0.26 |
0 |
|
|
323320 |
126674154 |
1 |
O2F3H11C12 |
A2B3C11D12 |
-214.2 |
1.6 |
-10.32 |
-1.14 |
0 |
|
|
323321 |
126674162 |
2 |
O2F3C10H12 |
A2B3C10D12 |
-510.72 |
4.48 |
-10.28 |
-1.18 |
0 |
|
|
323322 |
126674164 |
1 |
FCl2O2C12H13 |
AB2C2D12E13 |
-148.57 |
3.55 |
-10.19 |
-0.97 |
0 |
|
|
323323 |
126674167 |
1 |
OF6N7C24H25 |
AB6C7D24E25 |
-244.32 |
8.42 |
-8.89 |
-0.93 |
0 |
|
|
323324 |
126674168 |
1 |
OF6N7C24H25 |
AB6C7D24E25 |
-245.38 |
7.33 |
-8.8 |
-0.8 |
0 |
|
|
323325 |
126674170 |
1 |
OF6N7C24H25 |
AB6C7D24E25 |
-249.75 |
1.61 |
-8.84 |
-1.17 |
0 |
|
|
323326 |
126674172 |
1 |
SF3N6C24H27 |
AB3C6D24E27 |
-65.41 |
9.67 |
-8.41 |
-0.68 |
0 |
|
|
323327 |
126674173 |
1 |
SF3N6C24H27 |
AB3C6D24E27 |
-64.51 |
7.32 |
-8.43 |
-0.62 |
0 |
|
|
323328 |
126674174 |
1 |
ClN7C15H20 |
AB7C15D20 |
73.69 |
2.11 |
-8.65 |
-0.11 |
0 |
|
|
323329 |
126674185 |
1 |
N5F6C21H23 |
A5B6C21D23 |
-156.92 |
3.44 |
-8.49 |
-0.64 |
0 |
|
|
323330 |
126674186 |
1 |
SF3N6C23H25 |
AB3C6D23E25 |
-37.24 |
7.03 |
-8.43 |
-0.65 |
0 |
|
|
323331 |
126674191 |
1 |
BrN3F4H6C13 |
AB3C4D6E13 |
-112.94 |
4.1 |
-9.93 |
-1.34 |
0 |
|
|
323332 |
126674192 |
1 |
N5F6H19C21 |
A5B6C19D21 |
-220.6 |
3.37 |
-9.02 |
-1.58 |
0 |
|
|
323333 |
126674225 |
1 |
F4N5C20H23 |
A4B5C20D23 |
-141.08 |
5.4 |
-8.65 |
-0.87 |
0 |
|
|
323334 |
126674229 |
1 |
SF3N6H23C24 |
AB3C6D23E24 |
-31.28 |
5.86 |
-8.51 |
-1.25 |
0 |
|
|
323335 |
126674247 |
1 |
BrN6C14H15 |
AB6C14D15 |
213.06 |
7.39 |
-8.91 |
-1.04 |
0 |
|
|
323336 |
126674291 |
1 |
SO2N6C24H24 |
AB2C6D24E24 |
67.31 |
4.66 |
-8.49 |
-1.04 |
0 |