List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
80366 |
49834180 |
1 |
ClSN4O4C23H25 |
ABC4D4E23F25 |
-90.01 |
9.94 |
-9.03 |
-0.23 |
0 |
|
|
80367 |
49834181 |
1 |
ClSN4O4C22H23 |
ABC4D4E22F23 |
-72.13 |
9.03 |
-8.2 |
-0.12 |
0 |
|
|
80368 |
49834184 |
1 |
SO2N5C15H21 |
AB2C5D15E21 |
-47.38 |
1.13 |
-8.9 |
-0.57 |
0 |
|
|
80369 |
49834186 |
1 |
O30C61H100 |
A30B61C100 |
-1414.5 |
4.58 |
-8.54 |
0.04 |
0 |
|
|
80370 |
49834190 |
1 |
ClS2F3O4N5C28H31 |
AB2C3D4E5F28G31 |
-242.13 |
9.1 |
-8.76 |
-1.68 |
0 |
|
|
80371 |
49834191 |
1 |
N10O11C50H84 |
A10B11C50D84 |
-566.33 |
5.78 |
-9.39 |
-0.67 |
0 |
|
|
80372 |
49834193 |
1 |
OF3N5C14H18 |
AB3C5D14E18 |
-116.47 |
4.61 |
-9.19 |
-0.52 |
0 |
|
|
80373 |
49834195 |
1 |
F2N5C12H15 |
A2B5C12D15 |
-2.39 |
4.37 |
-9.45 |
-0.63 |
0 |
|
|
80374 |
49834209 |
1 |
F3O3N4C21H21 |
A3B3C4D21E21 |
-151.96 |
5.92 |
-9.76 |
-0.99 |
0 |
|
|
80375 |
49834214 |
1 |
FCl2O3N10H27C35 |
AB2C3D10E27F35 |
67.16 |
9.05 |
-9.39 |
-1.21 |
0 |
|
|
80376 |
49834215 |
1 |
Cl2F3O5N8H33C37 |
A2B3C5D8E33F37 |
-214.25 |
8.59 |
-9.25 |
-1.08 |
0 |
|
|
80377 |
49834216 |
1 |
FCl2O4N8H31C38 |
AB2C4D8E31F38 |
-20.59 |
6.0 |
-9.35 |
-1.16 |
0 |
|
|
80378 |
49834218 |
1 |
SO2N8C26H32 |
AB2C8D26E32 |
23.64 |
7.03 |
-8.53 |
-0.72 |
0 |
|
|
80379 |
49834220 |
1 |
OSN6C27H32 |
ABC6D27E32 |
69.18 |
5.66 |
-8.49 |
-0.89 |
0 |
|
|
80380 |
49834221 |
1 |
SO2N8C28H36 |
AB2C8D28E36 |
6.52 |
6.19 |
-8.45 |
-0.94 |
0 |
|
|
80381 |
49834226 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-70.63 |
3.87 |
-8.5 |
-0.68 |
0 |
|
|
80382 |
49834232 |
1 |
O3N4C22H22 |
A3B4C22D22 |
-26.81 |
4.76 |
-8.33 |
-0.45 |
0 |
|
|
80383 |
49834233 |
1 |
FON3H18C21 |
ABC3D18E21 |
-10.51 |
7.03 |
-8.83 |
-0.69 |
0 |
|
|
80384 |
49834238 |
1 |
ON5H17C19 |
AB5C17D19 |
63.65 |
4.9 |
-9.02 |
-0.69 |
0 |
|
|
80385 |
49834250 |
1 |
FN2O3C19H19 |
AB2C3D19E19 |
-114.77 |
8.17 |
-8.53 |
-0.78 |
0 |
|
|
80386 |
49834256 |
1 |
ClFN2O3H18C19 |
ABC2D3E18F19 |
-121.01 |
6.77 |
-8.46 |
-0.82 |
0 |
|
|
80387 |
49834261 |
1 |
SF2O2N6H14C18 |
AB2C2D6E14F18 |
-19.76 |
5.5 |
-9.3 |
-1.2 |
0 |
|
|
80388 |
49834264 |
1 |
SF2O2N6H18C20 |
AB2C2D6E18F20 |
-36.89 |
6.62 |
-9.27 |
-1.04 |
0 |
|
|
80389 |
49834269 |
1 |
NS3O15H19C20 |
AB3C15D19E20 |
-581.75 |
6.46 |
-9.96 |
-1.86 |
0 |
|
|
80390 |
49834272 |
1 |
N7O8C39H51 |
A7B8C39D51 |
-334.22 |
11.2 |
-8.63 |
-0.18 |
0 |
|
|
80391 |
49834274 |
2 |
N3O4C16H24 |
A3B4C16D24 |
-379.91 |
11.45 |
-9.39 |
0.21 |
0 |
|
|
80392 |
49834278 |
1 |
SO3N4C26H30 |
AB3C4D26E30 |
-63.79 |
2.54 |
-8.57 |
-0.77 |
0 |
|
|
80393 |
49834281 |
1 |
SN3O3C23H23 |
AB3C3D23E23 |
-36.23 |
1.99 |
-8.94 |
-0.81 |
0 |
|
|
80394 |
49834283 |
1 |
BN3O6C18H18 |
AB3C6D18E18 |
-220.78 |
6.0 |
-9.72 |
-1.18 |
0 |
|
|
80396 |
49834286 |
1 |
N7O10C26H51 |
A7B10C26D51 |
-455.26 |
3.48 |
-9.36 |
0.38 |
0 |
|
|
80397 |
49834290 |
6 |
NO2C4H8 |
AB2C4D8 |
-520.42 |
9.44 |
-9.26 |
0.72 |
0 |
|
|
80398 |
49834293 |
1 |
F2N6O13C24H46 |
A2B6C13D24E46 |
-701.57 |
3.67 |
-9.87 |
-0.11 |
0 |
|
|
80399 |
49834296 |
1 |
FIN3O5C30H33 |
ABC3D5E30F33 |
-131.33 |
24.01 |
-7.96 |
-1.13 |
0 |
|
|
80401 |
49834307 |
1 |
SN4O11C35H46 |
AB4C11D35E46 |
-451.65 |
1.91 |
-9.75 |
-0.28 |
0 |
|
|
80402 |
49834308 |
1 |
FNO3C21H24 |
ABC3D21E24 |
-138.39 |
5.35 |
-9.02 |
-0.68 |
0 |
|
|
80403 |
49834309 |
1 |
FON2C21H23 |
ABC2D21E23 |
-25.58 |
5.76 |
-9.04 |
-0.58 |
0 |
|
|
80404 |
49834310 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-115.4 |
1.27 |
-9.82 |
-0.5 |
0 |
|
|
80405 |
49834318 |
1 |
O2N4C25H30 |
A2B4C25D30 |
-39.75 |
2.9 |
-8.88 |
-0.15 |
0 |
|
|
80408 |
49834326 |
1 |
NSF2O7H35C36 |
ABC2D7E35F36 |
-302.94 |
8.79 |
-9.09 |
-1.1 |
0 |
|
|
80409 |
49834330 |
1 |
BrN2O3C21H25 |
AB2C3D21E25 |
-63.57 |
3.63 |
-9.2 |
-0.55 |
0 |
|
|
80410 |
49834331 |
1 |
BrO2N3C24H30 |
AB2C3D24E30 |
-24.05 |
4.54 |
-8.77 |
-0.32 |
0 |
|
|
80411 |
49834332 |
1 |
BrO2N4C24H31 |
AB2C4D24E31 |
-14.87 |
5.28 |
-8.91 |
-0.48 |
0 |
|
|
80412 |
49834334 |
1 |
O2N4C25H34 |
A2B4C25D34 |
-33.0 |
5.68 |
-8.78 |
-0.38 |
0 |
|
|
80413 |
49834339 |
1 |
BrFN2O2H20C25 |
ABC2D2E20F25 |
-47.34 |
4.47 |
-8.79 |
-0.5 |
0 |
|
|
80414 |
49834343 |
2 |
N4H17C18 |
A4B17C18 |
180.47 |
3.26 |
-8.47 |
-0.91 |
0 |
|
|
80415 |
49834345 |
1 |
O2N9H33C36 |
A2B9C33D36 |
123.6 |
5.42 |
-8.35 |
-1.0 |
0 |
|
|
80416 |
49834347 |
1 |
FCl2N2O3H25C28 |
AB2C2D3E25F28 |
-114.29 |
5.08 |
-8.81 |
-0.54 |
0 |
|
|
80417 |
49834349 |
1 |
ClSN3O3H20C24 |
ABC3D3E20F24 |
-22.02 |
4.25 |
-9.2 |
-1.44 |
0 |
|
|
80418 |
49834353 |
1 |
ClSO3N4C22H23 |
ABC3D4E22F23 |
-49.07 |
8.36 |
-9.01 |
-0.39 |
0 |
|
|
80419 |
49834370 |
1 |
SN2F4O4H22C25 |
AB2C4D4E22F25 |
-305.66 |
5.68 |
-9.59 |
-0.85 |
0 |
|
|
80420 |
49834374 |
1 |
N5C21H21 |
A5B21C21 |
138.94 |
4.88 |
-9.01 |
-0.62 |
0 |
|
|
80421 |
49834379 |
1 |
F3O3C16H17 |
A3B3C16D17 |
-287.17 |
5.38 |
-10.0 |
-0.77 |
0 |
|
|
80422 |
49834380 |
1 |
FO3N6C24H27 |
AB3C6D24E27 |
-56.63 |
5.21 |
-8.84 |
-0.82 |
0 |
|
|
80423 |
49834387 |
1 |
FCl2O3N10H29C36 |
AB2C3D10E29F36 |
74.2 |
7.75 |
-9.35 |
-1.13 |
0 |
|
|
80424 |
49834392 |
1 |
SO2N8C27H34 |
AB2C8D27E34 |
11.67 |
3.13 |
-8.52 |
-0.75 |
0 |
|
|
80425 |
49834393 |
1 |
O2N9C28H37 |
A2B9C28D37 |
31.44 |
6.35 |
-8.56 |
-0.68 |
0 |
|
|
80426 |
49834400 |
2 |
NOC9H9 |
ABC9D9 |
-19.23 |
4.85 |
-8.55 |
-0.66 |
0 |
|
|
80427 |
49834407 |
1 |
SN2O2C14H14 |
AB2C2D14E14 |
-31.73 |
6.98 |
-8.92 |
-1.26 |
0 |
|
|
80428 |
49834408 |
1 |
SN2O2H18C20 |
AB2C2D18E20 |
-7.87 |
8.12 |
-8.78 |
-1.25 |
0 |
|
|
80429 |
49834413 |
1 |
BrN8C24H27 |
AB8C24D27 |
105.85 |
4.49 |
-8.07 |
-0.54 |
0 |
|
|
80430 |
49834419 |
1 |
ClN2O3C25H29 |
AB2C3D25E29 |
-93.05 |
6.88 |
-8.3 |
-0.61 |
0 |
|
|
80431 |
49834421 |
1 |
SF2O2N6H18C20 |
AB2C2D6E18F20 |
-42.49 |
5.53 |
-9.14 |
-0.99 |
0 |
|
|
80432 |
49834432 |
1 |
N6O8C39H70 |
A6B8C39D70 |
-453.08 |
12.27 |
-9.51 |
-0.1 |
0 |
|
|
80434 |
49834441 |
2 |
N3O4C14H23 |
A3B4C14D23 |
-399.06 |
10.56 |
-9.74 |
0.06 |
0 |
|
|
80435 |
49834451 |
1 |
SO3N4C26H28 |
AB3C4D26E28 |
-26.48 |
4.2 |
-9.13 |
-0.98 |
0 |
|
|
80436 |
49834452 |
1 |
BN3O6C15H16 |
AB3C6D15E16 |
-282.13 |
13.22 |
-9.18 |
-0.86 |
0 |
|
|
80437 |
49834453 |
1 |
BN3O6C15H16 |
AB3C6D15E16 |
-276.69 |
9.9 |
-8.89 |
-0.89 |
0 |
|
|
80438 |
49834456 |
1 |
N7O9C26H51 |
A7B9C26D51 |
-409.97 |
2.19 |
-9.11 |
0.48 |
0 |
|
|
80439 |
49834459 |
1 |
SN7O8C40H51 |
AB7C8D40E51 |
-258.41 |
8.73 |
-8.9 |
-0.89 |
0 |
|
|
80440 |
49834464 |
1 |
N5O13C25H47 |
A5B13C25D47 |
-583.6 |
5.58 |
-9.64 |
0.52 |
0 |
|
|
80441 |
49834466 |
1 |
IF2N3O4C30H34 |
AB2C3D4E30F34 |
-129.01 |
17.21 |
-8.31 |
-0.97 |
0 |
|
|
80442 |
49834470 |
1 |
IN3O4C31H38 |
AB3C4D31E38 |
-100.18 |
3.02 |
-8.7 |
-0.36 |
0 |
|
|
80443 |
49834482 |
2 |
NO2C11H15 |
AB2C11D15 |
-195.05 |
2.06 |
-9.69 |
-0.47 |
0 |
|
|
80444 |
49834484 |
1 |
ClNO2C11H16 |
ABC2D11E16 |
-102.26 |
6.92 |
-9.22 |
-0.37 |
0 |
|
|
80446 |
49834500 |
1 |
FNO7H34C35 |
ABC7D34E35 |
-245.2 |
1.9 |
-9.55 |
-0.85 |
0 |
|
|
80447 |
49834502 |
1 |
FNO8H34C35 |
ABC8D34E35 |
-238.33 |
6.66 |
-8.93 |
-0.87 |
0 |
|
|
80448 |
49834507 |
1 |
O2N3C26H41 |
A2B3C26D41 |
-83.72 |
4.38 |
-8.63 |
0.75 |
0 |
|
|
80449 |
49834516 |
1 |
F3N8H31C36 |
A3B8C31D36 |
26.38 |
2.47 |
-8.61 |
-0.89 |
0 |
|
|
80450 |
49834527 |
1 |
SO3N4C22H24 |
AB3C4D22E24 |
-38.73 |
5.88 |
-8.68 |
-0.22 |
0 |
|
|
80451 |
49834528 |
1 |
ClSO3N4C21H21 |
ABC3D4E21F21 |
-46.6 |
9.65 |
-9.07 |
-0.41 |
0 |
|
|
80452 |
49834537 |
1 |
SN3O3C9H13 |
AB3C3D9E13 |
-118.31 |
4.49 |
-9.24 |
-0.61 |
0 |
|
|
80453 |
49834542 |
1 |
SO3N4F7H23C30 |
AB3C4D7E23F30 |
-381.74 |
6.74 |
-9.92 |
-1.62 |
0 |
|
|
80454 |
49834543 |
1 |
SO3N4F7H23C30 |
AB3C4D7E23F30 |
-374.71 |
8.91 |
-9.65 |
-1.37 |
0 |
|
|
80455 |
49834544 |
1 |
SO3F4N5H23C28 |
AB3C4D5E23F28 |
-207.35 |
8.95 |
-9.96 |
-1.3 |
0 |
|
|
80456 |
49834553 |
1 |
BrOF3H10C12 |
ABC3D10E12 |
-185.36 |
2.59 |
-10.04 |
-1.05 |
0 |
|
|
80457 |
49834555 |
1 |
F3O3C17H19 |
A3B3C17D19 |
-295.76 |
3.7 |
-9.98 |
-0.75 |
0 |
|
|
80458 |
49834569 |
1 |
FCl2O4N8H31C39 |
AB2C4D8E31F39 |
10.61 |
5.73 |
-9.43 |
-1.25 |
0 |
|
|
80459 |
49834571 |
1 |
Cl2F4O5N7H31C39 |
A2B4C5D7E31F39 |
-234.62 |
8.19 |
-9.3 |
-1.03 |
0 |
|
|
80460 |
49834577 |
1 |
O2N8C29H38 |
A2B8C29D38 |
24.86 |
8.9 |
-8.52 |
-0.65 |
0 |
|
|
80461 |
49834578 |
1 |
O3N8C28H38 |
A3B8C28D38 |
-31.98 |
7.37 |
-8.67 |
-0.84 |
0 |
|
|
80462 |
49834582 |
1 |
N2O3C18H18 |
A2B3C18D18 |
-62.24 |
3.78 |
-8.51 |
-0.77 |
0 |
|
|
80463 |
49834584 |
1 |
N2O3C24H28 |
A2B3C24D28 |
-78.3 |
7.62 |
-8.21 |
-0.42 |
0 |
|
|
80464 |
49834585 |
2 |
NOC11H12 |
ABC11D12 |
-29.54 |
5.54 |
-8.54 |
-0.71 |
0 |
|
|
80465 |
49834586 |
1 |
FN2O3H17C18 |
AB2C3D17E18 |
-107.75 |
5.85 |
-8.59 |
-0.84 |
0 |
|
|
80466 |
49834588 |
1 |
ClON8C26H31 |
ABC8D26E31 |
81.87 |
9.3 |
-7.88 |
-0.31 |
0 |
|
|
80467 |
49834593 |
1 |
N2O3C25H30 |
A2B3C25D30 |
-85.53 |
7.46 |
-8.22 |
-0.47 |
0 |
|
|
80468 |
49834595 |
1 |
N2O3C25H30 |
A2B3C25D30 |
-84.84 |
5.9 |
-8.27 |
-0.62 |
0 |
|
|
80469 |
49834596 |
1 |
FN2O3H19C23 |
AB2C3D19E23 |
-74.99 |
6.11 |
-8.68 |
-0.96 |
0 |
|
|
80470 |
49834608 |
1 |
S2N5O8C35H47 |
A2B5C8D35E47 |
-349.08 |
9.42 |
-8.69 |
-1.45 |
0 |
|
|
80471 |
49834609 |
1 |
FNBr2O2H8C15 |
ABC2D2E8F15 |
-56.09 |
1.44 |
-9.12 |
-1.34 |
0 |