List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
363289 |
127310547 |
1 |
O2N5C19H33 |
A2B5C19D33 |
-60.61 |
4.91 |
-8.92 |
-0.19 |
0 |
|
|
363290 |
127310548 |
1 |
O2N5C20H35 |
A2B5C20D35 |
-79.09 |
5.17 |
-8.62 |
0.76 |
0 |
|
|
363291 |
127310549 |
2 |
ON2C9H15 |
AB2C9D15 |
-78.89 |
1.98 |
-9.06 |
0.81 |
0 |
|
|
363292 |
127310550 |
1 |
O2N5C19H33 |
A2B5C19D33 |
-60.42 |
5.04 |
-8.94 |
-0.25 |
0 |
|
|
363293 |
127310551 |
1 |
O3N5C17H29 |
A3B5C17D29 |
-90.1 |
2.55 |
-9.09 |
-0.36 |
0 |
|
|
363294 |
127310552 |
1 |
O2N5C16H27 |
A2B5C16D27 |
-56.18 |
5.68 |
-8.84 |
0.75 |
0 |
|
|
363295 |
127310712 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-106.21 |
7.94 |
-8.19 |
-0.87 |
0 |
|
|
363296 |
127310713 |
1 |
SO2N3C17H29 |
AB2C3D17E29 |
-117.72 |
2.67 |
-8.44 |
0.76 |
0 |
|
|
363297 |
127310714 |
1 |
S2N3O3C17H31 |
A2B3C3D17E31 |
-148.25 |
6.08 |
-8.5 |
0.53 |
0 |
|
|
363298 |
127310715 |
1 |
SN2O3C16H28 |
AB2C3D16E28 |
-144.47 |
4.51 |
-8.43 |
0.76 |
0 |
|
|
363299 |
127310716 |
1 |
OSN4C20H34 |
ABC4D20E34 |
-49.17 |
7.86 |
-8.24 |
0.3 |
0 |
|
|
363300 |
127310717 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-36.75 |
4.11 |
-8.47 |
-1.22 |
0 |
|
|
363301 |
127310718 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-61.55 |
3.49 |
-8.68 |
-0.3 |
0 |
|
|
363302 |
127310719 |
1 |
OSN4C21H30 |
ABC4D21E30 |
-23.9 |
2.2 |
-8.44 |
-0.32 |
0 |
|
|
363303 |
127310720 |
1 |
SO2N3C19H33 |
AB2C3D19E33 |
-124.84 |
5.17 |
-8.64 |
0.57 |
0 |
|
|
363304 |
127310721 |
1 |
SO2N3C19H29 |
AB2C3D19E29 |
-51.39 |
2.87 |
-8.42 |
-0.42 |
0 |
|
|
363305 |
127310722 |
1 |
O2S2N3C19H29 |
A2B2C3D19E29 |
-88.48 |
2.9 |
-8.54 |
-0.89 |
0 |
|
|
363306 |
127310723 |
1 |
SO2N3C21H37 |
AB2C3D21E37 |
-135.87 |
3.85 |
-8.56 |
0.67 |
0 |
|
|
363307 |
127310724 |
1 |
SO2N3C21H37 |
AB2C3D21E37 |
-134.79 |
3.64 |
-8.52 |
0.7 |
0 |
|
|
363308 |
127310725 |
1 |
OSN5C20H29 |
ABC5D20E29 |
-4.45 |
1.25 |
-8.64 |
-0.83 |
0 |
|
|
363309 |
127310726 |
1 |
SN2O3C20H30 |
AB2C3D20E30 |
-114.21 |
4.84 |
-8.47 |
-0.35 |
0 |
|
|
363310 |
127310727 |
1 |
SO2N3C20H35 |
AB2C3D20E35 |
-135.07 |
4.67 |
-8.54 |
0.7 |
0 |
|
|
363311 |
127310728 |
1 |
OS2N6C17H24 |
AB2C6D17E24 |
54.18 |
9.18 |
-8.59 |
-1.78 |
0 |
|
|
363312 |
127310729 |
1 |
OSN6C19H26 |
ABC6D19E26 |
52.64 |
9.38 |
-8.59 |
-1.39 |
0 |
|
|
363313 |
127310730 |
1 |
O2S2N3C18H31 |
A2B2C3D18E31 |
-110.08 |
2.47 |
-8.5 |
0.04 |
0 |
|
|
363314 |
127310731 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-104.57 |
1.67 |
-8.53 |
-0.8 |
0 |
|
|
363315 |
127310732 |
1 |
SN2O2C20H30 |
AB2C2D20E30 |
-93.3 |
5.4 |
-8.35 |
0.02 |
0 |
|
|
363316 |
127310828 |
1 |
OSN5C17H23 |
ABC5D17E23 |
24.56 |
5.86 |
-8.77 |
-0.98 |
0 |
|
|
363317 |
127310829 |
1 |
ON5C19H29 |
AB5C19D29 |
2.05 |
1.58 |
-8.52 |
-0.93 |
0 |
|
|
363318 |
127310830 |
1 |
OSN6C19H28 |
ABC6D19E28 |
19.84 |
5.27 |
-8.52 |
-1.2 |
0 |
|
|
363319 |
127310831 |
1 |
OSN6C16H18 |
ABC6D16E18 |
59.79 |
2.4 |
-9.05 |
-0.91 |
0 |
|
|
363320 |
127310832 |
1 |
ON5C16H19 |
AB5C16D19 |
44.17 |
5.26 |
-9.09 |
-0.94 |
0 |
|
|
363321 |
127310833 |
1 |
OSN6C16H18 |
ABC6D16E18 |
60.14 |
5.37 |
-9.28 |
-1.22 |
0 |
|
|
363322 |
127310834 |
1 |
OSN5C20H29 |
ABC5D20E29 |
8.02 |
5.26 |
-8.64 |
-1.09 |
0 |
|
|
363323 |
127310835 |
2 |
ON3C8H10 |
AB3C8D10 |
43.75 |
4.15 |
-9.52 |
-0.85 |
0 |
|
|
363324 |
127310836 |
1 |
SO2N7C16H19 |
AB2C7D16E19 |
59.81 |
5.72 |
-9.16 |
-1.12 |
0 |
|
|
363325 |
127310837 |
1 |
FO2N6C20H23 |
AB2C6D20E23 |
-6.94 |
2.41 |
-9.22 |
-0.95 |
0 |
|
|
363326 |
127310838 |
1 |
O2N6C19H24 |
A2B6C19D24 |
7.73 |
3.75 |
-9.62 |
-0.8 |
0 |
|
|
363327 |
127310839 |
1 |
OSN4C17H20 |
ABC4D17E20 |
26.69 |
4.03 |
-9.13 |
-0.89 |
0 |
|
|
363328 |
127310840 |
1 |
ON5C16H19 |
AB5C16D19 |
35.44 |
4.37 |
-8.9 |
-0.86 |
0 |
|
|
363329 |
127310841 |
1 |
OSN5C17H21 |
ABC5D17E21 |
57.75 |
4.59 |
-8.99 |
-0.67 |
0 |
|
|
363330 |
127310842 |
1 |
OS2N6C17H20 |
AB2C6D17E20 |
77.56 |
3.0 |
-9.08 |
-1.11 |
0 |
|
|
363331 |
127310843 |
1 |
OSN5C18H25 |
ABC5D18E25 |
17.62 |
5.78 |
-8.6 |
-0.97 |
0 |
|
|
363332 |
127310844 |
1 |
SN4O4C15H20 |
AB4C4D15E20 |
-108.15 |
2.94 |
-10.34 |
-1.19 |
0 |
|
|
363333 |
127310845 |
1 |
S2O4N5C15H19 |
A2B4C5D15E19 |
-99.9 |
7.25 |
-9.5 |
-1.56 |
0 |
|
|
363334 |
127310846 |
1 |
OSN4C16H20 |
ABC4D16E20 |
29.72 |
4.85 |
-9.12 |
-0.96 |
0 |
|
|
363335 |
127310847 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-49.49 |
6.18 |
-9.22 |
-0.9 |
0 |
|
|
363336 |
127310848 |
1 |
O2N5C18H23 |
A2B5C18D23 |
2.36 |
4.6 |
-9.21 |
-0.72 |
0 |
|
|
363337 |
127310866 |
1 |
OSN7C19H23 |
ABC7D19E23 |
78.23 |
6.99 |
-8.62 |
-1.23 |
0 |
|
|
363338 |
127310867 |
1 |
OSN5C18H23 |
ABC5D18E23 |
47.03 |
3.65 |
-9.06 |
-0.72 |
0 |
|
|
363339 |
127310868 |
1 |
ON6C18H24 |
AB6C18D24 |
64.69 |
3.1 |
-9.09 |
-0.74 |
0 |
|
|
363340 |
127310869 |
1 |
OSN7C18H23 |
ABC7D18E23 |
82.41 |
1.98 |
-9.0 |
-1.02 |
0 |
|
|
363341 |
127310870 |
1 |
ON6C19H26 |
AB6C19D26 |
58.76 |
3.99 |
-9.0 |
-0.74 |
0 |
|
|
363342 |
127310871 |
1 |
ON6C20H28 |
AB6C20D28 |
52.53 |
2.94 |
-9.02 |
-0.75 |
0 |
|
|
363343 |
127310872 |
1 |
ON5C18H23 |
AB5C18D23 |
37.24 |
1.88 |
-9.01 |
-0.68 |
0 |
|
|
363344 |
127310873 |
1 |
OSN6C18H22 |
ABC6D18E22 |
54.26 |
5.06 |
-8.91 |
-0.97 |
0 |
|
|
363345 |
127310874 |
1 |
ON5C18H23 |
AB5C18D23 |
33.77 |
6.23 |
-9.27 |
-0.69 |
0 |
|
|
363346 |
127310875 |
1 |
OSN6C18H22 |
ABC6D18E22 |
52.69 |
3.59 |
-8.85 |
-1.23 |
0 |
|
|
363347 |
127310876 |
1 |
OSN7C15H17 |
ABC7D15E17 |
84.11 |
4.36 |
-9.29 |
-1.23 |
0 |
|
|
363348 |
127310877 |
1 |
ON5C17H21 |
AB5C17D21 |
48.96 |
2.91 |
-9.02 |
-0.83 |
0 |
|
|
363349 |
127310878 |
1 |
OSN6C17H20 |
ABC6D17E20 |
66.67 |
2.9 |
-8.99 |
-1.2 |
0 |
|
|
363350 |
127310879 |
1 |
OSN5C15H19 |
ABC5D15E19 |
38.75 |
1.41 |
-8.85 |
-1.04 |
0 |
|
|
363351 |
127310880 |
1 |
ON6C17H22 |
AB6C17D22 |
53.84 |
6.87 |
-9.06 |
-0.83 |
0 |
|
|
363352 |
127310886 |
1 |
FON4C21H27 |
ABC4D21E27 |
-45.93 |
4.65 |
-8.94 |
-1.05 |
0 |
|
|
363353 |
127310887 |
1 |
ON5C18H27 |
AB5C18D27 |
15.82 |
4.54 |
-8.49 |
-0.72 |
0 |
|
|
363354 |
127310888 |
1 |
OSN6C18H26 |
ABC6D18E26 |
33.61 |
6.63 |
-8.49 |
-0.99 |
0 |
|
|
363355 |
127310889 |
1 |
ON5C16H25 |
AB5C16D25 |
8.72 |
3.37 |
-8.4 |
-0.92 |
0 |
|
|
363356 |
127310890 |
1 |
OSN6C16H24 |
ABC6D16E24 |
25.52 |
4.74 |
-8.22 |
-1.2 |
0 |
|
|
363357 |
127310891 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-25.28 |
3.3 |
-9.71 |
-0.89 |
0 |
|
|
363358 |
127310892 |
1 |
SO2N4C13H16 |
AB2C4D13E16 |
-9.19 |
4.62 |
-9.11 |
-1.11 |
0 |
|
|
363359 |
127310893 |
1 |
OSN7C18H21 |
ABC7D18E21 |
97.41 |
2.33 |
-9.17 |
-1.05 |
0 |
|
|
363360 |
127310894 |
1 |
ON5C19H29 |
AB5C19D29 |
9.62 |
4.93 |
-8.71 |
-0.77 |
0 |
|
|
363361 |
127310898 |
1 |
O3N5C17H23 |
A3B5C17D23 |
-77.49 |
5.57 |
-9.32 |
-1.13 |
0 |
|
|
363362 |
127310899 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-35.77 |
3.98 |
-9.55 |
-0.78 |
0 |
|
|
363363 |
127310900 |
1 |
SO2N4C15H20 |
AB2C4D15E20 |
-18.66 |
6.86 |
-9.14 |
-1.08 |
0 |
|
|
363364 |
127310901 |
1 |
OSN5C17H23 |
ABC5D17E23 |
25.48 |
3.38 |
-8.79 |
-1.03 |
0 |
|
|
363365 |
127310902 |
1 |
O2N6C17H22 |
A2B6C17D22 |
39.93 |
4.27 |
-8.99 |
-0.84 |
0 |
|
|
363366 |
127310903 |
1 |
OSN7C18H21 |
ABC7D18E21 |
97.14 |
4.53 |
-9.1 |
-0.94 |
0 |
|
|
363367 |
127310904 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-50.35 |
5.61 |
-9.25 |
-0.88 |
0 |
|
|
363368 |
127310905 |
1 |
O3N5C19H27 |
A3B5C19D27 |
-67.02 |
5.07 |
-9.16 |
-0.88 |
0 |
|
|
363369 |
127310906 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-38.07 |
3.82 |
-8.84 |
-0.72 |
0 |
|
|
363370 |
127310907 |
1 |
ON5C19H29 |
AB5C19D29 |
9.98 |
4.64 |
-8.41 |
-0.72 |
0 |
|
|
363371 |
127310908 |
1 |
OSN6C19H28 |
ABC6D19E28 |
26.21 |
3.71 |
-8.35 |
-1.04 |
0 |
|
|
363372 |
127310909 |
1 |
SO2N4C15H16 |
AB2C4D15E16 |
20.84 |
4.48 |
-9.51 |
-0.99 |
0 |
|
|
363373 |
127310910 |
1 |
O2S2N5C15H15 |
A2B2C5D15E15 |
35.99 |
3.31 |
-9.19 |
-1.16 |
0 |
|
|
363374 |
127310911 |
1 |
O2N6C17H22 |
A2B6C17D22 |
38.11 |
4.37 |
-9.43 |
-0.83 |
0 |
|
|
363375 |
127310912 |
1 |
SO2N7C17H21 |
AB2C7D17E21 |
54.12 |
6.0 |
-9.15 |
-1.1 |
0 |
|
|
363376 |
127310913 |
1 |
O2N5C18H23 |
A2B5C18D23 |
3.71 |
3.99 |
-9.01 |
-1.13 |
0 |
|
|
363377 |
127310914 |
1 |
SO2N6C18H22 |
AB2C6D18E22 |
19.11 |
7.8 |
-8.83 |
-1.37 |
0 |
|
|
363378 |
127310915 |
1 |
OSN5C17H21 |
ABC5D17E21 |
49.53 |
4.71 |
-9.01 |
-0.87 |
0 |
|
|
363379 |
127310916 |
1 |
OS2N6C17H20 |
AB2C6D17E20 |
65.73 |
5.2 |
-8.96 |
-1.07 |
0 |
|
|
363380 |
127310917 |
1 |
SO2N5C18H25 |
AB2C5D18E25 |
-16.78 |
3.57 |
-8.88 |
-1.08 |
0 |
|
|
363381 |
127310918 |
1 |
ON4C16H24 |
AB4C16D24 |
-1.35 |
3.69 |
-8.69 |
-0.9 |
0 |
|
|
363382 |
127310919 |
1 |
OSN5C16H23 |
ABC5D16E23 |
14.67 |
4.09 |
-8.79 |
-1.07 |
0 |
|
|
363383 |
127310920 |
1 |
ON5C15H23 |
AB5C15D23 |
16.17 |
3.4 |
-8.49 |
-0.88 |
0 |
|
|
363384 |
127310921 |
1 |
OSN6C15H22 |
ABC6D15E22 |
34.19 |
7.84 |
-8.46 |
-1.16 |
0 |
|
|
363385 |
127310922 |
1 |
FON5C19H26 |
ABC5D19E26 |
-31.0 |
6.55 |
-8.86 |
-0.8 |
0 |
|
|
363386 |
127310923 |
1 |
O2N5C16H19 |
A2B5C16D19 |
26.65 |
4.77 |
-9.55 |
-1.04 |
0 |
|
|
363387 |
127310924 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-43.66 |
2.88 |
-8.7 |
-0.95 |
0 |
|
|
363388 |
127310925 |
1 |
SO2N5C19H27 |
AB2C5D19E27 |
-25.47 |
6.61 |
-8.61 |
-1.28 |
0 |