List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
208295 |
80516368 |
1 |
O2N3C9H13 |
A2B3C9D13 |
-48.34 |
3.4 |
-9.37 |
-1.09 |
0 |
|
|
208296 |
80516453 |
1 |
SN3O4C12H19 |
AB3C4D12E19 |
-150.1 |
6.72 |
-9.13 |
-1.11 |
0 |
|
|
208297 |
80516454 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-72.33 |
1.39 |
-9.14 |
-0.93 |
0 |
|
|
208298 |
80516455 |
1 |
O2N3C10H15 |
A2B3C10D15 |
-54.32 |
2.84 |
-9.48 |
-1.14 |
0 |
|
|
208299 |
80516491 |
1 |
SN3O4C13H15 |
AB3C4D13E15 |
-103.67 |
9.7 |
-10.23 |
-1.52 |
0 |
|
|
208300 |
80516689 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-16.58 |
3.15 |
-8.96 |
-0.92 |
0 |
|
|
208301 |
80516690 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-81.39 |
2.15 |
-8.6 |
-0.53 |
0 |
|
|
208302 |
80516691 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-12.82 |
3.48 |
-9.13 |
-0.94 |
0 |
|
|
208303 |
80516692 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-101.37 |
4.57 |
-9.04 |
-0.9 |
0 |
|
|
208304 |
80516739 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-40.05 |
2.95 |
-8.92 |
-1.37 |
0 |
|
|
208305 |
80516881 |
1 |
SN3O4C13H19 |
AB3C4D13E19 |
-161.97 |
5.96 |
-9.6 |
-0.42 |
0 |
|
|
208306 |
80516882 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-120.29 |
0.79 |
-8.89 |
-0.91 |
0 |
|
|
208307 |
80516883 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-9.57 |
2.0 |
-9.15 |
-0.98 |
0 |
|
|
208308 |
80516884 |
1 |
O2N4C13H14 |
A2B4C13D14 |
0.08 |
3.64 |
-9.43 |
-1.22 |
0 |
|
|
208309 |
80516885 |
1 |
O2F3N3C8H8 |
A2B3C3D8E8 |
-187.65 |
3.28 |
-10.0 |
-1.61 |
0 |
|
|
208310 |
80516886 |
1 |
SN3O4C13H15 |
AB3C4D13E15 |
-122.27 |
10.53 |
-9.92 |
-1.33 |
0 |
|
|
208311 |
80516887 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-46.74 |
2.88 |
-9.05 |
-1.36 |
0 |
|
|
208312 |
80516888 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-57.64 |
3.67 |
-8.96 |
-0.82 |
0 |
|
|
208313 |
80517268 |
2 |
OH2N3C4 |
AB2C3D4 |
80.21 |
6.81 |
-10.91 |
-2.45 |
0 |
|
|
208314 |
80517359 |
1 |
N2O3C14H14 |
A2B3C14D14 |
-60.15 |
3.62 |
-9.45 |
-1.55 |
0 |
|
|
208315 |
80517435 |
1 |
FN2O3H7C11 |
AB2C3D7E11 |
-80.11 |
2.36 |
-10.27 |
-1.79 |
0 |
|
|
208316 |
80517777 |
1 |
F2O2N3H11C13 |
A2B2C3D11E13 |
-106.48 |
1.25 |
-9.71 |
-1.35 |
0 |
|
|
208317 |
80517804 |
2 |
ON2C6H10 |
AB2C6D10 |
-47.21 |
4.16 |
-8.94 |
-1.14 |
0 |
|
|
208318 |
80517805 |
1 |
O2N5C11H13 |
A2B5C11D13 |
2.2 |
3.99 |
-9.59 |
-1.4 |
0 |
|
|
208319 |
80517806 |
1 |
O2N3C9H13 |
A2B3C9D13 |
-56.76 |
1.21 |
-9.5 |
-1.08 |
0 |
|
|
208320 |
80518559 |
1 |
N2S2O5C10H12 |
A2B2C5D10E12 |
-169.71 |
9.86 |
-10.43 |
-1.47 |
0 |
|
|
208321 |
80518926 |
1 |
SO2N4C12H16 |
AB2C4D12E16 |
-34.08 |
4.64 |
-9.15 |
-0.4 |
0 |
|
|
208322 |
80519333 |
1 |
SN2O5C12H22 |
AB2C5D12E22 |
-245.0 |
7.26 |
-10.24 |
0.19 |
0 |
|
|
208323 |
80520332 |
1 |
NS2O4C10H17 |
AB2C4D10E17 |
-183.25 |
6.21 |
-9.04 |
0.04 |
0 |
|
|
208324 |
80520333 |
1 |
SN3O4C11H17 |
AB3C4D11E17 |
-139.0 |
5.36 |
-9.96 |
0.08 |
0 |
|
|
208325 |
80520334 |
1 |
NS2O4C14H19 |
AB2C4D14E19 |
-136.26 |
8.74 |
-9.38 |
-0.54 |
0 |
|
|
208326 |
80520335 |
1 |
ClNSO5C13H16 |
ABCD5E13F16 |
-202.49 |
7.4 |
-9.54 |
-0.74 |
0 |
|
|
208327 |
80520336 |
1 |
NS2O4C14H21 |
AB2C4D14E21 |
-163.02 |
8.81 |
-9.41 |
-0.48 |
0 |
|
|
208328 |
80520380 |
1 |
BrSF2N2O3C12H13 |
ABC2D2E3F12G13 |
-195.09 |
7.52 |
-9.61 |
-1.02 |
0 |
|
|
208329 |
80520443 |
1 |
SO3N4C13H20 |
AB3C4D13E20 |
-100.44 |
3.74 |
-9.29 |
-0.57 |
0 |
|
|
208330 |
80520444 |
1 |
BrSN2O3C14H19 |
ABC2D3E14F19 |
-124.2 |
5.07 |
-9.37 |
-0.41 |
0 |
|
|
208331 |
80520639 |
1 |
O2N3C11H13 |
A2B3C11D13 |
-45.52 |
3.85 |
-8.84 |
-0.59 |
0 |
|
|
208332 |
80520738 |
1 |
SN2O4C11H22 |
AB2C4D11E22 |
-208.62 |
2.9 |
-9.65 |
0.78 |
0 |
|
|
208333 |
80520918 |
1 |
FSN2O3C13H17 |
ABC2D3E13F17 |
-173.19 |
6.64 |
-8.93 |
-0.02 |
0 |
|
|
208334 |
80520932 |
1 |
SN2O3C14H26 |
AB2C3D14E26 |
-167.59 |
4.03 |
-9.5 |
0.7 |
0 |
|
|
208335 |
80520933 |
1 |
SN2O5C12H20 |
AB2C5D12E20 |
-237.11 |
6.58 |
-9.71 |
0.24 |
0 |
|
|
208336 |
80520934 |
1 |
SN3O4C12H23 |
AB3C4D12E23 |
-180.49 |
7.79 |
-8.87 |
0.96 |
0 |
|
|
208337 |
80520935 |
1 |
SN3O3C10H17 |
AB3C3D10E17 |
-122.45 |
8.39 |
-10.1 |
0.44 |
0 |
|
|
208338 |
80520936 |
1 |
SN2O6C11H20 |
AB2C6D11E20 |
-269.49 |
8.85 |
-9.88 |
0.49 |
0 |
|
|
208339 |
80520995 |
1 |
SO3N4C10H16 |
AB3C4D10E16 |
-100.76 |
7.81 |
-9.55 |
0.16 |
0 |
|
|
208340 |
80521447 |
1 |
O2N3C11H13 |
A2B3C11D13 |
4.99 |
5.59 |
-9.11 |
-0.49 |
0 |
|
|
208341 |
80521481 |
1 |
ON3C16H23 |
AB3C16D23 |
10.48 |
4.52 |
-9.02 |
-0.44 |
0 |
|
|
208342 |
80521482 |
1 |
OSN3C15H15 |
ABC3D15E15 |
63.61 |
2.54 |
-8.69 |
-0.26 |
0 |
|
|
208343 |
80521655 |
1 |
N2C19H32 |
A2B19C32 |
-9.93 |
4.0 |
-8.96 |
0.27 |
0 |
|
|
208344 |
80521848 |
1 |
ON3C16H19 |
AB3C16D19 |
39.52 |
4.5 |
-9.03 |
-0.42 |
0 |