List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
418292 |
135104079 |
1 |
NSO6C18H27 |
ABC6D18E27 |
-266.37 |
4.73 |
-9.21 |
-0.77 |
0 |
|
|
418293 |
135104083 |
1 |
NSO5C18H25 |
ABC5D18E25 |
-200.72 |
11.82 |
-9.92 |
-0.82 |
0 |
|
|
418294 |
135104084 |
1 |
O2N3F4C16H17 |
A2B3C4D16E17 |
-241.13 |
5.01 |
-9.46 |
-0.81 |
0 |
|
|
418295 |
135104085 |
1 |
OSF3N5C16H18 |
ABC3D5E16F18 |
-120.13 |
3.43 |
-9.34 |
-1.1 |
0 |
|
|
418296 |
135104086 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-85.31 |
5.74 |
-8.43 |
0.13 |
0 |
|
|
418297 |
135104087 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-106.63 |
2.05 |
-9.28 |
-0.59 |
0 |
|
|
418298 |
135104088 |
1 |
SN4O4C13H22 |
AB4C4D13E22 |
-138.14 |
7.01 |
-9.66 |
-0.01 |
0 |
|
|
418299 |
135104089 |
1 |
ON4C17H28 |
AB4C17D28 |
-21.13 |
2.63 |
-7.84 |
0.57 |
0 |
|
|
418300 |
135104090 |
1 |
O3N4C16H22 |
A3B4C16D22 |
-37.86 |
6.27 |
-9.46 |
-0.3 |
0 |
|
|
418301 |
135104101 |
1 |
NSO3C20H31 |
ABC3D20E31 |
-151.26 |
7.06 |
-9.4 |
-0.54 |
0 |
|
|
418302 |
135104109 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-87.35 |
4.15 |
-9.29 |
-0.57 |
0 |
|
|
418303 |
135104143 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-80.55 |
3.67 |
-8.34 |
0.09 |
0 |
|
|
418304 |
135104149 |
1 |
NO4C23H27 |
AB4C23D27 |
-154.93 |
7.91 |
-9.4 |
-0.22 |
0 |
|
|
418305 |
135104161 |
1 |
FN2O4C20H23 |
AB2C4D20E23 |
-147.16 |
5.29 |
-9.29 |
-1.35 |
0 |
|
|
418306 |
135104166 |
1 |
OF3N4C16H19 |
AB3C4D16E19 |
-145.52 |
4.43 |
-9.12 |
-0.84 |
0 |
|
|
418307 |
135104170 |
1 |
FO2N3C20H20 |
AB2C3D20E20 |
-58.06 |
7.01 |
-8.88 |
-0.4 |
0 |
|
|
418308 |
135104171 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-19.12 |
6.07 |
-8.62 |
-0.27 |
0 |
|
|
418309 |
135104173 |
1 |
ClON2C20H29 |
ABC2D20E29 |
-51.05 |
4.04 |
-8.46 |
0.0 |
0 |
|
|
418310 |
135104174 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-44.67 |
4.23 |
-8.92 |
-0.72 |
0 |
|
|
418311 |
135104177 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-68.9 |
5.6 |
-8.72 |
-0.8 |
0 |
|
|
418312 |
135104178 |
1 |
SN3O5C16H19 |
AB3C5D16E19 |
-126.7 |
4.62 |
-9.64 |
-1.22 |
0 |
|
|
418313 |
135104179 |
1 |
ON4C25H26 |
AB4C25D26 |
29.78 |
2.34 |
-9.29 |
-0.84 |
0 |
|
|
418314 |
135104180 |
1 |
N5C19H27 |
A5B19C27 |
40.89 |
5.93 |
-8.92 |
-0.33 |
0 |
|
|
418315 |
135104181 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-137.43 |
2.28 |
-8.83 |
0.0 |
0 |
|
|
418316 |
135104182 |
1 |
ON5C13H23 |
AB5C13D23 |
-10.16 |
2.47 |
-9.15 |
0.49 |
0 |
|
|
418317 |
135104183 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-173.49 |
3.82 |
-9.03 |
-0.27 |
0 |
|
|
418318 |
135104184 |
1 |
SO2N5C25H29 |
AB2C5D25E29 |
9.0 |
4.96 |
-9.06 |
-0.59 |
0 |
|
|
418319 |
135104185 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-36.75 |
3.71 |
-8.72 |
0.1 |
0 |
|
|
418320 |
135104186 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-125.18 |
6.15 |
-9.55 |
-0.64 |
0 |
|
|
418321 |
135104187 |
1 |
NSO7C14H19 |
ABC7D14E19 |
-273.87 |
7.24 |
-9.04 |
-0.59 |
0 |
|
|
418322 |
135104188 |
1 |
NS2O5C16H23 |
AB2C5D16E23 |
-200.81 |
10.3 |
-9.84 |
-0.88 |
0 |
|
|
418323 |
135104189 |
1 |
ClFSN2O4C14H18 |
ABCD2E4F14G18 |
-200.01 |
8.46 |
-9.6 |
-0.5 |
0 |
|
|
418324 |
135104192 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-193.15 |
6.89 |
-9.38 |
-0.95 |
0 |
|
|
418325 |
135104193 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-43.13 |
5.09 |
-8.29 |
-0.15 |
0 |
|
|
418326 |
135104194 |
1 |
ClN3O3C20H26 |
AB3C3D20E26 |
-81.84 |
3.19 |
-9.38 |
-1.04 |
0 |
|
|
418327 |
135104195 |
1 |
SN2O4C21H30 |
AB2C4D21E30 |
-183.21 |
8.91 |
-9.19 |
-0.52 |
0 |
|
|
418328 |
135104196 |
1 |
O3N4C20H24 |
A3B4C20D24 |
-85.36 |
5.58 |
-9.49 |
-0.78 |
0 |
|
|
418329 |
135104197 |
1 |
N5C23H25 |
A5B23C25 |
85.43 |
3.2 |
-8.65 |
-0.72 |
0 |
|
|
418330 |
135104198 |
1 |
ON5C15H17 |
AB5C15D17 |
44.42 |
3.58 |
-9.38 |
-1.14 |
0 |
|
|
418331 |
135104199 |
1 |
N6O6C31H48 |
A6B6C31D48 |
-293.25 |
5.6 |
-9.43 |
0.22 |
0 |
|
|
418332 |
135104208 |
1 |
ON2F3C15H17 |
AB2C3D15E17 |
-130.04 |
3.57 |
-9.49 |
-0.64 |
0 |
|
|
418333 |
135104210 |
2 |
ON3C9H14 |
AB3C9D14 |
-60.89 |
3.02 |
-8.51 |
0.04 |
0 |
|
|
418334 |
135104217 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-18.04 |
1.98 |
-9.17 |
-0.79 |
0 |
|
|
418335 |
135104219 |
1 |
SN3O4C14H19 |
AB3C4D14E19 |
-106.09 |
4.85 |
-8.7 |
-0.21 |
0 |
|
|
418336 |
135104221 |
1 |
N2O3C21H30 |
A2B3C21D30 |
-145.1 |
8.04 |
-9.04 |
0.38 |
0 |
|
|
418337 |
135104222 |
1 |
SO2N5C17H19 |
AB2C5D17E19 |
6.8 |
7.68 |
-8.83 |
-0.86 |
0 |
|
|
418338 |
135104223 |
1 |
ON5C12H15 |
AB5C12D15 |
1.98 |
9.57 |
-9.48 |
-0.5 |
0 |
|
|
418339 |
135104228 |
1 |
SO2N5C19H29 |
AB2C5D19E29 |
-45.41 |
6.05 |
-8.86 |
-1.0 |
0 |
|
|
418340 |
135104232 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-48.62 |
4.47 |
-8.76 |
0.64 |
0 |
|
|
418341 |
135104234 |
1 |
ON5C18H25 |
AB5C18D25 |
9.6 |
3.24 |
-8.3 |
-0.21 |
0 |
|
|
418342 |
135104236 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-80.75 |
5.66 |
-9.0 |
0.06 |
0 |
|
|
418343 |
135104237 |
1 |
O2N5C21H33 |
A2B5C21D33 |
-36.05 |
5.06 |
-8.4 |
0.11 |
0 |
|
|
418344 |
135104238 |
1 |
O5N8C36H48 |
A5B8C36D48 |
-163.91 |
5.16 |
-9.66 |
-0.5 |
0 |
|
|
418345 |
135104239 |
1 |
O2N5C18H19 |
A2B5C18D19 |
10.31 |
1.09 |
-8.82 |
-0.91 |
0 |
|
|
418346 |
135104240 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-136.18 |
6.26 |
-8.38 |
-0.57 |
0 |
|
|
418347 |
135104241 |
1 |
O2N6C21H26 |
A2B6C21D26 |
-11.44 |
5.5 |
-8.49 |
-1.16 |
0 |
|
|
418348 |
135104242 |
1 |
OF2N4C21H26 |
AB2C4D21E26 |
-73.01 |
2.62 |
-8.61 |
-0.33 |
0 |
|
|
418349 |
135104248 |
1 |
FSN6O7C35H47 |
ABC6D7E35F47 |
-316.28 |
3.19 |
-8.63 |
-0.7 |
0 |
|
|
418350 |
135104253 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-99.09 |
5.19 |
-8.85 |
-0.42 |
0 |
|
|
418351 |
135104256 |
1 |
O3N6C14H20 |
A3B6C14D20 |
-79.32 |
3.57 |
-8.9 |
-0.82 |
0 |
|
|
418353 |
135104290 |
1 |
ON4C19H20 |
AB4C19D20 |
28.43 |
6.34 |
-8.11 |
-0.7 |
0 |
|
|
418354 |
135104296 |
1 |
NO5C16H23 |
AB5C16D23 |
-197.12 |
5.95 |
-8.23 |
0.21 |
0 |
|
|
418355 |
135104298 |
1 |
ClON4C16H21 |
ABC4D16E21 |
-6.89 |
4.21 |
-8.97 |
-0.56 |
0 |
|
|
418357 |
135104305 |
1 |
NSO2C18H27 |
ABC2D18E27 |
-95.74 |
2.54 |
-8.29 |
0.2 |
0 |
|
|
418358 |
135104306 |
2 |
NO4C16H18 |
AB4C16D18 |
-172.97 |
4.54 |
-8.22 |
-0.86 |
0 |
|
|
418359 |
135104320 |
1 |
O3N4C21H24 |
A3B4C21D24 |
-32.82 |
2.1 |
-9.01 |
-0.84 |
0 |
|
|
418361 |
135104323 |
1 |
N5O5C34H45 |
A5B5C34D45 |
-179.12 |
6.34 |
-9.57 |
-0.5 |
0 |
|
|
418362 |
135104325 |
1 |
ClSN2O3C16H23 |
ABC2D3E16F23 |
-118.92 |
2.66 |
-8.86 |
-0.99 |
0 |
|
|
418363 |
135104327 |
1 |
O2N3C17H25 |
A2B3C17D25 |
-74.31 |
3.8 |
-8.72 |
-0.31 |
0 |
|
|
418364 |
135104328 |
1 |
SO4N5C14H21 |
AB4C5D14E21 |
-99.11 |
4.76 |
-8.82 |
-0.16 |
0 |
|
|
418365 |
135104338 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-39.98 |
2.53 |
-8.19 |
-0.38 |
0 |
|
|
418366 |
135104366 |
1 |
SO3N4C16H22 |
AB3C4D16E22 |
-42.02 |
8.47 |
-9.25 |
-0.59 |
0 |
|
|
418367 |
135104367 |
1 |
N7O7C38H49 |
A7B7C38D49 |
-279.26 |
11.36 |
-8.54 |
-0.17 |
0 |
|
|
418368 |
135104368 |
1 |
ON2F6C16H16 |
AB2C6D16E16 |
-339.93 |
7.42 |
-9.55 |
-1.26 |
0 |
|
|
418369 |
135104369 |
1 |
SO2N4C18H20 |
AB2C4D18E20 |
24.57 |
6.82 |
-9.19 |
-1.19 |
0 |
|
|
418370 |
135104389 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-79.19 |
3.72 |
-8.75 |
-0.25 |
0 |
|
|
418371 |
135104390 |
1 |
NF2O4C21H23 |
AB2C4D21E23 |
-221.12 |
4.88 |
-9.13 |
-0.48 |
0 |
|
|
418372 |
135104391 |
1 |
NSO5C16H23 |
ABC5D16E23 |
-216.87 |
3.58 |
-9.68 |
-0.26 |
0 |
|
|
418373 |
135104392 |
1 |
FSN2O4C15H21 |
ABC2D4E15F21 |
-197.27 |
8.31 |
-9.66 |
-0.82 |
0 |
|
|
418374 |
135104393 |
2 |
O2N3C9H10 |
A2B3C9D10 |
-8.2 |
8.66 |
-9.66 |
-1.21 |
0 |
|
|
418375 |
135104394 |
1 |
ON3C16H21 |
AB3C16D21 |
1.98 |
2.18 |
-9.11 |
-0.2 |
0 |
|
|
418376 |
135104397 |
1 |
SN2O6C17H26 |
AB2C6D17E26 |
-226.83 |
2.83 |
-8.64 |
-0.31 |
0 |
|
|
418377 |
135104403 |
1 |
OS2N4C10H14 |
AB2C4D10E14 |
29.12 |
2.86 |
-8.99 |
-1.16 |
0 |
|
|
418378 |
135104440 |
1 |
SN2O6C14H20 |
AB2C6D14E20 |
-241.91 |
5.35 |
-9.22 |
-0.47 |
0 |
|
|
418379 |
135104441 |
1 |
S2N7O7C33H47 |
A2B7C7D33E47 |
-280.01 |
6.62 |
-8.95 |
-0.88 |
0 |
|
|
418380 |
135104447 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-48.88 |
4.62 |
-8.56 |
-0.19 |
0 |
|
|
418381 |
135104448 |
1 |
SO4N5C14H23 |
AB4C5D14E23 |
-129.88 |
3.88 |
-9.81 |
-0.26 |
0 |
|
|
418382 |
135104449 |
1 |
ClN2O4C19H25 |
AB2C4D19E25 |
-169.77 |
5.69 |
-9.61 |
-0.66 |
0 |
|
|
418383 |
135104450 |
1 |
ClN4C15H25 |
AB4C15D25 |
-0.37 |
4.45 |
-8.82 |
-0.21 |
0 |
|
|
418384 |
135104451 |
1 |
ON2C21H28 |
AB2C21D28 |
-20.14 |
4.45 |
-8.88 |
-0.12 |
0 |
|
|
418385 |
135104471 |
1 |
O2N3C18H21 |
A2B3C18D21 |
29.02 |
5.61 |
-9.11 |
-0.82 |
0 |
|
|
418386 |
135104488 |
1 |
ClN3O3C16H20 |
AB3C3D16E20 |
-63.07 |
6.07 |
-9.35 |
-1.02 |
0 |
|
|
418387 |
135104493 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-33.88 |
3.16 |
-8.63 |
-0.1 |
0 |
|
|
418388 |
135104495 |
1 |
FO2N3C14H14 |
AB2C3D14E14 |
-87.41 |
3.38 |
-9.05 |
-0.86 |
0 |
|
|
418389 |
135104496 |
1 |
FN3O4C19H24 |
AB3C4D19E24 |
-138.86 |
5.33 |
-8.96 |
-1.3 |
0 |
|
|
418390 |
135104497 |
1 |
ON5C13H19 |
AB5C13D19 |
37.95 |
2.92 |
-8.68 |
0.34 |
0 |
|
|
418391 |
135104498 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-40.06 |
4.52 |
-8.91 |
-0.04 |
0 |
|
|
418392 |
135104499 |
1 |
ON5C15H25 |
AB5C15D25 |
-15.42 |
2.69 |
-8.6 |
0.23 |
0 |
|
|
418393 |
135104500 |
1 |
NO2C16H21 |
AB2C16D21 |
-85.58 |
4.82 |
-9.32 |
-0.15 |
0 |
|
|
418394 |
135104501 |
1 |
N3O3F4C16H17 |
A3B3C4D16E17 |
-289.95 |
4.57 |
-9.31 |
-0.62 |
0 |