List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
421262 |
135115662 |
1 |
NO4C18H27 |
AB4C18D27 |
-176.19 |
4.31 |
-8.52 |
0.32 |
0 |
|
|
421264 |
135115665 |
2 |
N3O4C21H27 |
A3B4C21D27 |
-191.45 |
6.98 |
-8.33 |
-0.69 |
0 |
|
|
421265 |
135115666 |
1 |
NSO4C15H21 |
ABC4D15E21 |
-156.3 |
8.9 |
-9.13 |
-0.13 |
0 |
|
|
421266 |
135115667 |
1 |
ON5C25H29 |
AB5C25D29 |
28.29 |
4.57 |
-9.17 |
-0.5 |
0 |
|
|
421267 |
135115669 |
1 |
OSN3C17H23 |
ABC3D17E23 |
-0.93 |
5.04 |
-9.13 |
-0.23 |
0 |
|
|
421268 |
135115670 |
1 |
SF2N4O4C12H18 |
AB2C4D4E12F18 |
-225.91 |
5.75 |
-9.84 |
-0.24 |
0 |
|
|
421269 |
135115673 |
1 |
FO2N3C18H20 |
AB2C3D18E20 |
-92.3 |
3.58 |
-9.82 |
-0.68 |
0 |
|
|
421270 |
135115674 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-96.39 |
4.27 |
-9.16 |
-0.21 |
0 |
|
|
421271 |
135115675 |
1 |
N2O3C17H28 |
A2B3C17D28 |
-172.1 |
3.81 |
-9.3 |
0.99 |
0 |
|
|
421272 |
135115676 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-88.39 |
5.49 |
-8.9 |
0.04 |
0 |
|
|
421273 |
135115677 |
1 |
OSN4C19H24 |
ABC4D19E24 |
4.55 |
5.13 |
-8.65 |
-0.52 |
0 |
|
|
421274 |
135115679 |
1 |
FO2N3C13H14 |
AB2C3D13E14 |
-58.83 |
5.32 |
-8.83 |
-0.17 |
0 |
|
|
421275 |
135115680 |
1 |
SO3N5C20H27 |
AB3C5D20E27 |
-55.12 |
1.46 |
-9.4 |
-0.98 |
0 |
|
|
421276 |
135115681 |
1 |
FO2N4C11H15 |
AB2C4D11E15 |
-96.87 |
4.24 |
-9.02 |
-0.42 |
0 |
|
|
421277 |
135115683 |
2 |
N3O3C16H22 |
A3B3C16D22 |
-222.41 |
3.61 |
-9.47 |
-0.01 |
0 |
|
|
421279 |
135115685 |
1 |
O2N3C24H33 |
A2B3C24D33 |
-70.06 |
3.55 |
-8.72 |
-0.74 |
0 |
|
|
421280 |
135115687 |
1 |
FSN2O5C15H21 |
ABC2D5E15F21 |
-229.91 |
8.82 |
-8.96 |
-0.33 |
0 |
|
|
421281 |
135115688 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-170.7 |
2.94 |
-9.24 |
0.23 |
0 |
|
|
421282 |
135115689 |
2 |
ON2C7H9 |
AB2C7D9 |
-40.62 |
2.07 |
-8.84 |
-0.27 |
0 |
|
|
421283 |
135115690 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-96.09 |
9.79 |
-8.79 |
-0.39 |
0 |
|
|
421284 |
135115692 |
1 |
O2N5C16H19 |
A2B5C16D19 |
60.08 |
2.89 |
-8.96 |
-0.5 |
0 |
|
|
421286 |
135115695 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-43.12 |
7.42 |
-8.87 |
-0.34 |
0 |
|
|
421287 |
135115698 |
1 |
FNO5C24H28 |
ABC5D24E28 |
-237.31 |
3.8 |
-9.16 |
-0.36 |
0 |
|
|
421288 |
135115724 |
1 |
N5O7C33H45 |
A5B7C33D45 |
-259.86 |
6.57 |
-8.6 |
-0.09 |
0 |
|
|
421289 |
135115725 |
1 |
SO3N5C15H25 |
AB3C5D15E25 |
-83.25 |
3.92 |
-8.68 |
-0.14 |
0 |
|
|
421291 |
135115727 |
1 |
O3N6C27H34 |
A3B6C27D34 |
-82.64 |
5.86 |
-8.39 |
-0.41 |
0 |
|
|
421292 |
135115729 |
1 |
ClSO2N3C15H18 |
ABC2D3E15F18 |
-40.51 |
3.04 |
-8.82 |
-0.6 |
0 |
|
|
421293 |
135115731 |
1 |
N4O4C23H30 |
A4B4C23D30 |
-116.25 |
5.12 |
-8.69 |
-0.85 |
0 |
|
|
421294 |
135115732 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-7.18 |
1.55 |
-8.44 |
-0.72 |
0 |
|
|
421295 |
135115735 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-72.03 |
6.02 |
-9.01 |
0.36 |
0 |
|
|
421296 |
135115737 |
1 |
SN3O5C13H21 |
AB3C5D13E21 |
-184.33 |
6.52 |
-9.73 |
-0.58 |
0 |
|
|
421297 |
135115743 |
1 |
O4N5C23H25 |
A4B5C23D25 |
-24.99 |
9.75 |
-9.42 |
-1.04 |
0 |
|
|
421298 |
135115745 |
1 |
O3N4C20H24 |
A3B4C20D24 |
-22.13 |
5.23 |
-9.41 |
-0.78 |
0 |
|
|
421299 |
135115746 |
1 |
SN4O4C14H20 |
AB4C4D14E20 |
-113.84 |
2.95 |
-9.89 |
-0.6 |
0 |
|
|
421300 |
135115747 |
1 |
O2N3C16H23 |
A2B3C16D23 |
1.01 |
5.87 |
-9.12 |
0.11 |
0 |
|
|
421301 |
135115748 |
1 |
N3O3H19C20 |
A3B3C19D20 |
-48.19 |
2.44 |
-9.42 |
-0.81 |
0 |
|
|
421302 |
135115749 |
1 |
NF3O3C18H24 |
AB3C3D18E24 |
-296.67 |
6.01 |
-8.89 |
-0.41 |
0 |
|
|
421303 |
135115753 |
1 |
ON4C17H28 |
AB4C17D28 |
-33.82 |
3.85 |
-8.71 |
-0.47 |
0 |
|
|
421304 |
135115755 |
1 |
FN2O3C18H21 |
AB2C3D18E21 |
-121.94 |
4.11 |
-9.51 |
-0.21 |
0 |
|
|
421306 |
135115757 |
1 |
O5N6C26H36 |
A5B6C26D36 |
-163.69 |
7.04 |
-9.58 |
-0.58 |
0 |
|
|
421307 |
135115759 |
1 |
ON5C21H31 |
AB5C21D31 |
-1.35 |
5.12 |
-8.9 |
-0.41 |
0 |
|
|
421308 |
135115763 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-134.08 |
2.88 |
-9.13 |
-0.63 |
0 |
|
|
421309 |
135115764 |
1 |
SO5N8C34H44 |
AB5C8D34E44 |
-137.74 |
5.04 |
-9.16 |
-0.68 |
0 |
|
|
421310 |
135115767 |
1 |
N5O7C36H45 |
A5B7C36D45 |
-177.8 |
2.94 |
-8.87 |
-0.77 |
0 |
|
|
421311 |
135115768 |
1 |
ON5C18H27 |
AB5C18D27 |
37.5 |
3.06 |
-9.08 |
-0.28 |
0 |
|
|
421312 |
135115770 |
1 |
O3N4C16H26 |
A3B4C16D26 |
-135.67 |
4.27 |
-9.56 |
0.05 |
0 |
|
|
421313 |
135115772 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-96.94 |
2.68 |
-8.72 |
0.3 |
0 |
|
|
421314 |
135115773 |
1 |
ON2C22H28 |
AB2C22D28 |
-3.11 |
2.22 |
-8.8 |
-0.36 |
0 |
|
|
421315 |
135115774 |
1 |
SN3O5C17H23 |
AB3C5D17E23 |
-190.01 |
9.45 |
-9.62 |
-0.81 |
0 |
|
|
421316 |
135115776 |
1 |
N2O3C22H24 |
A2B3C22D24 |
-19.4 |
6.46 |
-9.46 |
-0.28 |
0 |
|
|
421317 |
135115777 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-56.31 |
5.87 |
-9.04 |
-0.24 |
0 |
|
|
421318 |
135115778 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-130.05 |
3.23 |
-8.83 |
-0.03 |
0 |
|
|
421319 |
135115779 |
1 |
ClSN2O4C15H21 |
ABC2D4E15F21 |
-162.09 |
4.8 |
-9.89 |
-0.73 |
0 |
|
|
421320 |
135115780 |
1 |
OS2N3C15H21 |
AB2C3D15E21 |
3.04 |
4.04 |
-9.02 |
-0.53 |
0 |
|
|
421321 |
135115781 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-41.4 |
4.39 |
-9.6 |
-0.89 |
0 |
|
|
421322 |
135115782 |
1 |
NSO5C15H21 |
ABC5D15E21 |
-211.94 |
10.74 |
-9.94 |
-0.82 |
0 |
|
|
421324 |
135115784 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-159.91 |
4.73 |
-8.96 |
-0.17 |
0 |
|
|
421325 |
135115785 |
1 |
O6N7C36H47 |
A6B7C36D47 |
-189.92 |
8.56 |
-8.94 |
-1.47 |
0 |
|
|
421326 |
135115786 |
1 |
O3N4C16H20 |
A3B4C16D20 |
-51.72 |
3.83 |
-9.51 |
-1.04 |
0 |
|
|
421327 |
135115788 |
1 |
N3O6C31H35 |
A3B6C31D35 |
-93.92 |
3.28 |
-8.15 |
-0.63 |
0 |
|
|
421328 |
135115789 |
1 |
N2O2C21H34 |
A2B2C21D34 |
-139.61 |
3.91 |
-8.99 |
1.48 |
0 |
|
|
421329 |
135115790 |
1 |
N4O4C21H22 |
A4B4C21D22 |
-41.88 |
3.53 |
-9.09 |
-1.06 |
0 |
|
|
421330 |
135115791 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-69.15 |
3.04 |
-8.9 |
0.38 |
0 |
|
|
421331 |
135115792 |
1 |
N6O7C39H44 |
A6B7C39D44 |
-210.11 |
9.83 |
-8.41 |
-0.21 |
0 |
|
|
421332 |
135115793 |
1 |
SO6N9C39H45 |
AB6C9D39E45 |
-138.82 |
9.44 |
-8.34 |
-1.36 |
0 |
|
|
421333 |
135115794 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-101.48 |
6.36 |
-9.16 |
-0.44 |
0 |
|
|
421334 |
135115795 |
1 |
N3O6C29H31 |
A3B6C29D31 |
-72.15 |
3.85 |
-8.22 |
-1.16 |
0 |
|
|
421335 |
135115796 |
1 |
SN7O7C38H51 |
AB7C7D38E51 |
-301.34 |
6.15 |
-8.85 |
-0.76 |
0 |
|
|
421336 |
135115797 |
1 |
ClON3C17H26 |
ABC3D17E26 |
-25.18 |
2.81 |
-8.48 |
0.61 |
0 |
|
|
421337 |
135115798 |
3 |
ON2C5H6 |
AB2C5D6 |
-57.36 |
5.61 |
-9.05 |
-0.43 |
0 |
|
|
421338 |
135115799 |
1 |
SO5N9C37H47 |
AB5C9D37E47 |
-119.54 |
6.46 |
-8.28 |
-1.1 |
0 |
|
|
421339 |
135115800 |
1 |
F2O4N5C34H41 |
A2B4C5D34E41 |
-248.93 |
4.75 |
-8.28 |
-0.3 |
0 |
|
|
421340 |
135115803 |
2 |
N4O4C19H27 |
A4B4C19D27 |
-332.76 |
9.36 |
-9.12 |
-0.1 |
0 |
|
|
421341 |
135115804 |
1 |
FO2N3C20H24 |
AB2C3D20E24 |
-89.75 |
5.34 |
-8.76 |
-0.22 |
0 |
|
|
421342 |
135115805 |
1 |
NO2C18H27 |
AB2C18D27 |
-82.0 |
2.26 |
-8.71 |
0.41 |
0 |
|
|
421343 |
135115806 |
1 |
SN3O5C13H21 |
AB3C5D13E21 |
-186.74 |
4.33 |
-9.73 |
-0.5 |
0 |
|
|
421344 |
135115809 |
1 |
N5O5C37H43 |
A5B5C37D43 |
-157.45 |
4.5 |
-9.59 |
-0.41 |
0 |
|
|
421345 |
135115810 |
1 |
NSO6H17C18 |
ABC6D17E18 |
-172.82 |
7.41 |
-8.91 |
-0.9 |
0 |
|
|
421346 |
135115811 |
1 |
ClSF3N3O3C13H17 |
ABC3D3E3F13G17 |
-264.41 |
6.31 |
-9.13 |
-0.68 |
0 |
|
|
421347 |
135115815 |
1 |
O3N6C20H26 |
A3B6C20D26 |
-94.7 |
4.65 |
-8.64 |
-0.69 |
0 |
|
|
421348 |
135115818 |
1 |
O2N5C21H37 |
A2B5C21D37 |
-103.83 |
4.5 |
-8.47 |
0.52 |
0 |
|
|
421349 |
135115820 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-56.3 |
2.47 |
-9.12 |
-0.38 |
0 |
|
|
421350 |
135115822 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-74.83 |
6.56 |
-9.31 |
-0.78 |
0 |
|
|
421351 |
135115823 |
1 |
SN3O3C18H25 |
AB3C3D18E25 |
-99.53 |
4.94 |
-8.05 |
-0.27 |
0 |
|
|
421352 |
135115824 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-19.28 |
3.86 |
-8.84 |
-0.74 |
0 |
|
|
421353 |
135115825 |
1 |
N4O9C35H40 |
A4B9C35D40 |
-263.42 |
5.86 |
-8.64 |
-0.97 |
0 |
|
|
421354 |
135115833 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-17.16 |
2.63 |
-8.61 |
-0.77 |
0 |
|
|
421355 |
135115846 |
1 |
N6O7C38H48 |
A6B7C38D48 |
-262.18 |
3.97 |
-8.88 |
-0.88 |
0 |
|
|
421356 |
135115856 |
1 |
N7C13H21 |
A7B13C21 |
64.27 |
2.7 |
-8.91 |
0.06 |
0 |
|
|
421357 |
135115857 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-94.42 |
2.1 |
-9.31 |
0.37 |
0 |
|
|
421358 |
135115858 |
1 |
ON2C22H30 |
AB2C22D30 |
-32.43 |
5.19 |
-8.72 |
-0.83 |
0 |
|
|
421359 |
135115860 |
1 |
FN2C18H21 |
AB2C18D21 |
-3.65 |
1.73 |
-9.03 |
-0.17 |
0 |
|
|
421360 |
135115862 |
1 |
ClN3O4C18H22 |
AB3C4D18E22 |
-102.5 |
4.91 |
-8.98 |
-1.1 |
0 |
|
|
421361 |
135115863 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-66.89 |
3.88 |
-9.49 |
-1.01 |
0 |
|
|
421362 |
135115864 |
1 |
ClFNOC17H23 |
ABCDE17F23 |
-92.96 |
2.51 |
-8.97 |
-0.3 |
0 |
|
|
421363 |
135115865 |
1 |
SO4N7C29H37 |
AB4C7D29E37 |
-81.57 |
4.62 |
-8.92 |
-0.48 |
0 |
|
|
421364 |
135115868 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-26.85 |
2.2 |
-8.43 |
-0.32 |
0 |
|
|
421365 |
135115871 |
1 |
N2O5C25H34 |
A2B5C25D34 |
-204.44 |
8.53 |
-8.52 |
-0.13 |
0 |
|
|
421366 |
135115872 |
1 |
OF3N3C16H22 |
AB3C3D16E22 |
-194.98 |
6.15 |
-9.24 |
-0.86 |
0 |
|
|
421367 |
135115873 |
2 |
O3N4C15H21 |
A3B4C15D21 |
-238.84 |
12.84 |
-9.15 |
-0.32 |
0 |