List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
124263 |
50876527 |
1 |
NSO3C16H21 |
ABC3D16E21 |
-100.33 |
6.92 |
-9.0 |
-0.82 |
0 |
|
|
124264 |
50876528 |
1 |
NSCl2O5H11C13 |
ABC2D5E11F13 |
-151.71 |
6.28 |
-9.21 |
-0.9 |
0 |
|
|
124265 |
50876578 |
1 |
SN2O4C14H24 |
AB2C4D14E24 |
-143.32 |
4.24 |
-8.77 |
-0.51 |
0 |
|
|
124266 |
50876639 |
1 |
NSO3C18H31 |
ABC3D18E31 |
-156.38 |
6.99 |
-9.23 |
-0.24 |
0 |
|
|
124267 |
50876640 |
1 |
NSO4C16H19 |
ABC4D16E19 |
-125.31 |
8.06 |
-8.21 |
-0.41 |
0 |
|
|
124268 |
50876641 |
1 |
NSO4C16H19 |
ABC4D16E19 |
-124.98 |
7.07 |
-8.04 |
-0.44 |
0 |
|
|
124269 |
50876695 |
1 |
N2S2O6C19H26 |
A2B2C6D19E26 |
-209.87 |
6.51 |
-9.4 |
-0.42 |
0 |
|
|
124270 |
50876720 |
1 |
BrNSO2C16H26 |
ABCD2E16F26 |
-112.06 |
4.35 |
-9.66 |
-0.75 |
0 |
|
|
124271 |
50876754 |
1 |
BrClSN2O2C12H12 |
ABCD2E2F12G12 |
-43.44 |
5.83 |
-9.29 |
-1.32 |
0 |
|
|
124272 |
50876845 |
1 |
NO4C14H17 |
AB4C14D17 |
-146.52 |
8.08 |
-9.15 |
-0.69 |
0 |
|
|
124273 |
50876865 |
1 |
NSO3C15H25 |
ABC3D15E25 |
-134.89 |
5.33 |
-9.21 |
-0.44 |
0 |
|
|
124274 |
50876866 |
1 |
NSBr2O3C10H13 |
ABC2D3E10F13 |
-105.27 |
2.83 |
-9.2 |
-1.06 |
0 |
|
|
124275 |
50876867 |
1 |
BrNSCl2O3C9H10 |
ABCD2E3F9G10 |
-106.75 |
4.52 |
-9.87 |
-1.35 |
0 |
|
|
124276 |
50876940 |
1 |
BrClNSO2C7H7 |
ABCDE2F7G7 |
-67.74 |
2.79 |
-9.18 |
-1.12 |
0 |
|
|
124277 |
50876941 |
1 |
BrNSO2C10H14 |
ABCD2E10F14 |
-77.12 |
3.7 |
-9.76 |
-0.81 |
0 |
|
|
124278 |
50876942 |
1 |
BrSCl2N2O2C12H15 |
ABC2D2E2F12G15 |
-62.83 |
4.66 |
-8.7 |
-1.41 |
0 |
|
|
124279 |
50876943 |
1 |
BrSCl2N2O2C17H17 |
ABC2D2E2F17G17 |
-34.69 |
2.82 |
-8.83 |
-1.4 |
0 |
|
|
124280 |
50876944 |
1 |
BrNSCl2O3C11H12 |
ABCD2E3F11G12 |
-114.63 |
5.4 |
-9.03 |
-1.3 |
0 |
|
|
124281 |
50877031 |
1 |
SN2O4C14H16 |
AB2C4D14E16 |
-138.87 |
5.24 |
-8.66 |
-1.62 |
0 |
|
|
124282 |
50877032 |
1 |
O3N4H10C13 |
A3B4C10D13 |
-41.49 |
6.5 |
-9.83 |
-1.78 |
0 |
|
|
124283 |
50877035 |
1 |
O3N4H16C20 |
A3B4C16D20 |
-24.65 |
7.6 |
-9.6 |
-1.75 |
0 |
|
|
124284 |
50877057 |
1 |
ON2C13H16 |
AB2C13D16 |
-11.11 |
2.29 |
-9.08 |
-0.77 |
0 |
|
|
124285 |
50877072 |
1 |
ClON2C12H13 |
ABC2D12E13 |
-13.92 |
1.07 |
-9.27 |
-1.06 |
0 |
|
|
124286 |
50877073 |
1 |
ClON2C12H13 |
ABC2D12E13 |
-13.75 |
2.93 |
-9.17 |
-1.06 |
0 |
|
|
124287 |
50877074 |
1 |
ClON2C11H11 |
ABC2D11E11 |
1.69 |
3.6 |
-9.24 |
-1.26 |
0 |
|
|
124288 |
50877075 |
1 |
ClON2H11C15 |
ABC2D11E15 |
39.93 |
3.27 |
-9.24 |
-1.28 |
0 |
|
|
124289 |
50877076 |
1 |
ClON2C13H15 |
ABC2D13E15 |
-20.79 |
2.87 |
-9.12 |
-1.03 |
0 |
|
|
124290 |
50877077 |
1 |
ClON2C12H13 |
ABC2D12E13 |
-5.51 |
3.68 |
-9.19 |
-1.22 |
0 |
|
|
124291 |
50877078 |
1 |
ClN3C12H16 |
AB3C12D16 |
18.76 |
5.19 |
-8.86 |
-0.4 |
0 |
|
|
124292 |
50877079 |
2 |
NOC6H7 |
ABC6D7 |
-46.39 |
5.55 |
-8.86 |
-0.49 |
0 |
|
|
124293 |
50877080 |
1 |
SC5N5H7 |
AB5C5D7 |
81.34 |
8.15 |
-8.44 |
-1.3 |
0 |
|
|
124294 |
50877176 |
1 |
FON3H10C12 |
ABC3D10E12 |
-28.28 |
6.61 |
-9.52 |
-1.31 |
0 |
|
|
124295 |
50877177 |
1 |
ON2H14C17 |
AB2C14D17 |
35.07 |
4.55 |
-8.67 |
-0.85 |
0 |
|
|
124296 |
50877221 |
1 |
ClN3C16H24 |
AB3C16D24 |
0.78 |
8.16 |
-8.67 |
-0.16 |
0 |
|
|
124297 |
50877414 |
1 |
N3O5C14H15 |
A3B5C14D15 |
-98.03 |
8.1 |
-9.31 |
-1.86 |
0 |
|
|
124298 |
50877480 |
1 |
NO3C14H15 |
AB3C14D15 |
-103.48 |
3.74 |
-9.14 |
-0.71 |
0 |
|
|
124299 |
50877481 |
1 |
NSO3H13C15 |
ABC3D13E15 |
-86.77 |
4.26 |
-8.85 |
-1.34 |
0 |
|
|
124300 |
50877652 |
1 |
SN2O4H10C12 |
AB2C4D10E12 |
-39.42 |
2.59 |
-8.67 |
-2.25 |
0 |
|
|
124301 |
50877659 |
1 |
ON4H8C10 |
AB4C8D10 |
33.98 |
7.44 |
-8.97 |
-1.04 |
0 |
|
|
124302 |
50877831 |
1 |
BrON2H13C17 |
ABC2D13E17 |
35.76 |
5.16 |
-8.94 |
-1.24 |
0 |
|
|
124303 |
50877874 |
1 |
BrClON3H13C17 |
ABCD3E13F17 |
17.37 |
7.6 |
-8.68 |
-0.95 |
0 |
|
|
124304 |
50877899 |
1 |
ON2H16C17 |
AB2C16D17 |
22.4 |
2.96 |
-8.44 |
-0.57 |
0 |
|
|
124305 |
50878036 |
1 |
BrN2F3H8C15 |
AB2C3D8E15 |
-56.81 |
2.27 |
-8.93 |
-1.35 |
0 |
|
|
124306 |
50878121 |
1 |
BrNO2H8C11 |
ABC2D8E11 |
-24.17 |
1.0 |
-9.41 |
-1.82 |
0 |
|
|
124307 |
50878122 |
1 |
ClNSO2H12C15 |
ABCD2E12F15 |
-23.65 |
2.33 |
-8.58 |
-0.68 |
0 |
|
|
124308 |
50878201 |
1 |
SN4O6H16C18 |
AB4C6D16E18 |
-81.33 |
6.39 |
-9.56 |
-1.6 |
0 |
|
|
124309 |
50878230 |
1 |
OSN2C11H14 |
ABC2D11E14 |
-39.34 |
3.88 |
-8.25 |
-0.29 |
0 |
|
|
124310 |
50878287 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-61.13 |
8.4 |
-9.22 |
-0.85 |
0 |
|
|
124311 |
50878441 |
1 |
ClSN6C8H9 |
ABC6D8E9 |
96.38 |
5.15 |
-8.5 |
-0.73 |
0 |
|
|
124312 |
50878447 |
1 |
O2S2N5H17C19 |
A2B2C5D17E19 |
61.26 |
5.25 |
-8.59 |
-1.14 |
0 |
|
|
124313 |
50878448 |
2 |
NOC11H12 |
ABC11D12 |
-15.35 |
4.51 |
-8.49 |
-0.65 |
0 |
|
|
124314 |
50878522 |
1 |
ClSN4O4H5C11 |
ABC4D4E5F11 |
76.8 |
7.39 |
-9.95 |
-2.17 |
0 |
|
|
124315 |
50878523 |
1 |
OSN3H11C13 |
ABC3D11E13 |
79.09 |
2.35 |
-8.65 |
-0.93 |
0 |
|
|
124316 |
50878524 |
1 |
O2N3H21C24 |
A2B3C21D24 |
34.41 |
7.92 |
-8.54 |
-0.5 |
0 |
|
|
124317 |
50878525 |
1 |
O2S2N5H17C19 |
A2B2C5D17E19 |
60.38 |
4.49 |
-8.52 |
-1.24 |
0 |
|
|
124318 |
50878526 |
1 |
NSH15C20 |
ABC15D20 |
103.09 |
3.32 |
-8.1 |
-0.68 |
0 |
|
|
124319 |
50878602 |
1 |
O5C23H32 |
A5B23C32 |
-243.72 |
2.38 |
-9.52 |
-0.01 |
0 |
|
|
124320 |
50878603 |
1 |
ClFN3H5C10 |
ABC3D5E10 |
25.33 |
3.31 |
-9.16 |
-1.28 |
0 |
|
|
124321 |
50878624 |
1 |
Cl2N2O3C16H16 |
A2B2C3D16E16 |
-96.18 |
1.76 |
-8.1 |
-0.72 |
0 |
|
|
124322 |
50878691 |
1 |
Br2N2O3C16H16 |
A2B2C3D16E16 |
-78.43 |
2.86 |
-8.35 |
-0.88 |
0 |
|
|
124323 |
50878692 |
1 |
BrN2O3C17H19 |
AB2C3D17E19 |
-85.21 |
3.64 |
-8.4 |
-0.43 |
0 |
|
|
124324 |
50878716 |
1 |
OSN5H15C18 |
ABC5D15E18 |
85.26 |
10.47 |
-9.26 |
-1.41 |
0 |
|
|
124325 |
50878717 |
1 |
OSN3C17H17 |
ABC3D17E17 |
18.52 |
4.51 |
-8.3 |
-0.48 |
0 |
|
|
124326 |
50878725 |
1 |
FOSN5H10C16 |
ABCD5E10F16 |
43.42 |
11.03 |
-9.23 |
-1.54 |
0 |
|
|
124327 |
50878729 |
1 |
ClOSN5H10C16 |
ABCD5E10F16 |
90.82 |
10.24 |
-9.47 |
-1.47 |
0 |
|
|
124328 |
50878770 |
1 |
ClN2O3C16H19 |
AB2C3D16E19 |
-108.4 |
4.26 |
-8.8 |
-0.81 |
0 |
|
|
124329 |
50878813 |
1 |
SO3N4H18C19 |
AB3C4D18E19 |
33.37 |
8.43 |
-9.14 |
-1.65 |
0 |
|
|
124330 |
50879174 |
1 |
BrO3H11C13 |
AB3C11D13 |
-70.53 |
1.21 |
-9.29 |
-1.08 |
0 |
|
|
124331 |
50879175 |
1 |
BrClO2H8C12 |
ABC2D8E12 |
-33.45 |
3.36 |
-9.54 |
-1.49 |
0 |
|
|
124332 |
50879275 |
1 |
SO2N3H13C16 |
AB2C3D13E16 |
22.13 |
0.73 |
-8.42 |
-0.82 |
0 |
|
|
124333 |
50879433 |
1 |
BrClN2O2C11H12 |
ABC2D2E11F12 |
3.86 |
6.43 |
-9.19 |
-1.64 |
0 |
|
|
124334 |
50879481 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-32.6 |
4.23 |
-8.76 |
-0.75 |
0 |
|
|
124335 |
50879482 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-35.02 |
4.24 |
-8.76 |
-0.75 |
0 |
|
|
124336 |
50879483 |
1 |
BrN2O3C13H17 |
AB2C3D13E17 |
-33.72 |
4.32 |
-8.81 |
-1.06 |
0 |
|
|
124337 |
50879484 |
2 |
ClNC5H7 |
ABC5D7 |
-7.89 |
3.43 |
-8.69 |
-0.26 |
0 |
|
|
124338 |
50879524 |
1 |
Cl2O2N3C11H13 |
A2B2C3D11E13 |
9.47 |
6.31 |
-8.89 |
-1.6 |
0 |
|
|
124339 |
50879533 |
1 |
Cl2N3C11H15 |
A2B3C11D15 |
9.46 |
4.26 |
-8.49 |
-0.36 |
0 |
|
|
124340 |
50879599 |
2 |
N2O2C7H10 |
A2B2C7D10 |
-59.38 |
9.45 |
-9.25 |
-0.87 |
0 |
|
|
124341 |
50879713 |
1 |
ClNO2H14C17 |
ABC2D14E17 |
-50.25 |
3.32 |
-8.55 |
-0.72 |
0 |
|
|
124342 |
50879844 |
1 |
OSN3C13H17 |
ABC3D13E17 |
-27.48 |
4.0 |
-8.6 |
-0.45 |
0 |
|
|
124343 |
50879849 |
1 |
O3N5C9H13 |
A3B5C9D13 |
-49.46 |
7.36 |
-9.39 |
-0.32 |
0 |
|
|
124344 |
50879880 |
1 |
Cl2N3O3H13C18 |
A2B3C3D13E18 |
-63.56 |
1.37 |
-9.32 |
-1.52 |
0 |
|
|
124345 |
50879925 |
1 |
SN2O3H14C18 |
AB2C3D14E18 |
-55.21 |
4.11 |
-9.31 |
-1.3 |
0 |
|
|
124346 |
50880118 |
1 |
OSN4H24C25 |
ABC4D24E25 |
57.91 |
1.83 |
-8.34 |
-0.57 |
0 |
|
|
124347 |
50880119 |
1 |
OSN4C26H26 |
ABC4D26E26 |
53.9 |
5.46 |
-8.37 |
-0.57 |
0 |
|
|
124348 |
50880146 |
1 |
Cl2N2O3H14C16 |
A2B2C3D14E16 |
-30.62 |
6.38 |
-9.77 |
-1.48 |
0 |
|
|
124349 |
50880147 |
1 |
Cl2N2O3H12C15 |
A2B2C3D12E15 |
-26.27 |
6.81 |
-9.82 |
-1.5 |
0 |
|
|
124350 |
50880148 |
1 |
Cl2N2O3H12C15 |
A2B2C3D12E15 |
-29.26 |
8.14 |
-9.87 |
-1.39 |
0 |
|
|
124351 |
50880149 |
1 |
SO2N4C24H24 |
AB2C4D24E24 |
9.93 |
5.86 |
-8.3 |
-0.84 |
0 |
|
|
124352 |
50880150 |
1 |
SO2N4C25H26 |
AB2C4D25E26 |
5.68 |
3.76 |
-8.25 |
-0.83 |
0 |
|
|
124353 |
50880151 |
1 |
BrOSN3H14C16 |
ABCD3E14F16 |
19.54 |
2.4 |
-8.63 |
-0.76 |
0 |
|
|
124354 |
50880170 |
1 |
ClN3O4C23H30 |
AB3C4D23E30 |
-128.42 |
7.07 |
-8.52 |
-0.05 |
0 |
|
|
124355 |
50880190 |
1 |
OSCl2N4H18C19 |
ABC2D4E18F19 |
20.0 |
5.94 |
-8.5 |
-0.94 |
0 |
|
|
124356 |
50880228 |
1 |
BrClO3C11H12 |
ABC3D11E12 |
-117.5 |
0.83 |
-9.56 |
-1.0 |
0 |
|
|
124357 |
50880229 |
1 |
BrClNOH7C9 |
ABCDE7F9 |
6.48 |
3.67 |
-9.53 |
-1.21 |
0 |
|
|
124358 |
50880230 |
1 |
OSN4C24H24 |
ABC4D24E24 |
47.62 |
5.51 |
-8.37 |
-0.81 |
0 |
|
|
124359 |
50880231 |
1 |
OSN4H22C23 |
ABC4D22E23 |
51.58 |
3.34 |
-8.35 |
-0.78 |
0 |
|
|
124360 |
50880441 |
1 |
OSN5C19H21 |
ABC5D19E21 |
41.49 |
6.0 |
-8.41 |
-0.76 |
0 |
|
|
124361 |
50880518 |
1 |
BrO2H13C14 |
AB2C13D14 |
-30.91 |
3.23 |
-9.2 |
-1.18 |
0 |
|
|
124362 |
50880519 |
1 |
BrO2C14H15 |
AB2C14D15 |
-53.48 |
1.15 |
-8.94 |
-0.74 |
0 |