List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
311837 |
126598192 |
1 |
NCl2C6H7 |
AB2C6D7 |
-8.14 |
2.76 |
-8.94 |
-0.45 |
0 |
|
|
311840 |
126598206 |
1 |
FOCl2N6C15H15 |
ABC2D6E15F15 |
-15.8 |
2.0 |
-8.68 |
-0.96 |
0 |
|
|
311841 |
126598207 |
1 |
N4O7C28H36 |
A4B7C28D36 |
-271.55 |
5.63 |
-8.96 |
-1.0 |
0 |
|
|
311843 |
126598252 |
1 |
NO6C23H25 |
AB6C23D25 |
-205.8 |
8.9 |
-9.08 |
-1.1 |
0 |
|
|
311845 |
126598341 |
1 |
FCl2O2N7C24H30 |
AB2C2D7E24F30 |
-100.13 |
2.41 |
-8.68 |
-0.94 |
0 |
|
|
311846 |
126598343 |
1 |
SN4O9C31H38 |
AB4C9D31E38 |
-317.99 |
5.07 |
-8.65 |
-1.11 |
0 |
|
|
311847 |
126598353 |
1 |
Cl2N6C15H16 |
A2B6C15D16 |
67.35 |
5.07 |
-8.7 |
-0.65 |
0 |
|
|
311848 |
126598379 |
1 |
N5C57H57 |
A5B57C57 |
150.03 |
1.07 |
-7.81 |
-0.97 |
0 |
|
|
311849 |
126598381 |
1 |
N2H50C57 |
A2B50C57 |
168.04 |
1.12 |
-8.01 |
-0.59 |
0 |
|
|
311850 |
126598389 |
1 |
NH45C48 |
AB45C48 |
99.14 |
2.05 |
-7.91 |
-0.33 |
0 |
|
|
311851 |
126598392 |
2 |
NC28H30 |
AB28C30 |
63.02 |
3.5 |
-7.97 |
-0.3 |
0 |
|
|
311852 |
126598398 |
1 |
N5H61C63 |
A5B61C63 |
162.58 |
2.78 |
-8.12 |
-0.81 |
0 |
|
|
311853 |
126598399 |
1 |
ON4H40C48 |
AB4C40D48 |
147.7 |
2.76 |
-8.15 |
-1.01 |
0 |
|
|
311854 |
126598408 |
1 |
BrNC21H24 |
ABC21D24 |
15.55 |
2.78 |
-8.25 |
-0.41 |
0 |
|
|
311855 |
126598410 |
2 |
N2H19C21 |
A2B19C21 |
141.75 |
2.29 |
-8.12 |
-1.04 |
0 |
|
|
311856 |
126598416 |
2 |
N2H23C27 |
A2B23C27 |
193.93 |
2.39 |
-8.02 |
-1.05 |
0 |
|
|
311857 |
126598440 |
1 |
ClF2O2N7C26H34 |
AB2C2D7E26F34 |
-119.7 |
3.57 |
-8.69 |
-0.69 |
0 |
|
|
311858 |
126598462 |
1 |
OCl2F3N7C24H28 |
AB2C3D7E24F28 |
-155.9 |
2.89 |
-8.74 |
-1.08 |
0 |
|
|
311859 |
126598498 |
1 |
N2H18C19 |
A2B18C19 |
69.83 |
3.97 |
-9.03 |
-0.16 |
0 |
|
|
311860 |
126598531 |
1 |
N3O5C24H29 |
A3B5C24D29 |
-166.77 |
11.58 |
-8.92 |
-1.43 |
0 |
|
|
311861 |
126598556 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-96.53 |
4.98 |
-8.72 |
-1.02 |
0 |
|
|
311862 |
126598558 |
1 |
N2H46C49 |
A2B46C49 |
132.37 |
2.94 |
-7.74 |
-0.48 |
0 |
|
|
311863 |
126598559 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-108.61 |
7.13 |
-8.68 |
-0.87 |
0 |
|
|
311864 |
126598567 |
2 |
NOC4H6 |
ABC4D6 |
-69.25 |
7.6 |
-10.0 |
0.18 |
0 |
|
|
311865 |
126598576 |
1 |
N4O4C21H24 |
A4B4C21D24 |
-111.28 |
7.43 |
-9.02 |
-1.15 |
0 |
|
|
311866 |
126598578 |
1 |
N3O5C23H31 |
A3B5C23D31 |
-212.34 |
8.36 |
-8.76 |
-0.93 |
0 |
|
|
311867 |
126598582 |
2 |
N2O2C9H9 |
A2B2C9D9 |
-96.76 |
9.87 |
-9.13 |
-1.18 |
0 |
|
|
311868 |
126598636 |
1 |
O3N4C29H46 |
A3B4C29D46 |
-132.91 |
2.33 |
-8.15 |
0.31 |
0 |
|
|
311869 |
126598656 |
1 |
NC13H21 |
AB13C21 |
19.01 |
2.77 |
-9.03 |
1.12 |
0 |
|
|
311870 |
126598657 |
2 |
NC4H7 |
AB4C7 |
33.71 |
0.49 |
-8.46 |
0.41 |
0 |
|
|
311871 |
126598660 |
1 |
N2C43H44 |
A2B43C44 |
71.05 |
0.97 |
-7.77 |
-0.29 |
0 |
|
|
311872 |
126598661 |
2 |
NH27C30 |
AB27C30 |
157.7 |
3.18 |
-7.95 |
-0.44 |
0 |
|
|
311873 |
126598669 |
1 |
ON2H48C57 |
AB2C48D57 |
145.19 |
1.94 |
-7.8 |
-0.61 |
0 |
|
|
311874 |
126598670 |
1 |
N2H40C45 |
A2B40C45 |
117.18 |
2.07 |
-7.92 |
-0.37 |
0 |
|
|
311875 |
126598681 |
1 |
BrNC30H34 |
ABC30D34 |
18.96 |
2.51 |
-8.02 |
-0.36 |
0 |
|
|
311877 |
126598685 |
1 |
N5H45C54 |
A5B45C54 |
205.71 |
2.42 |
-7.82 |
-1.23 |
0 |
|
|
311878 |
126598690 |
2 |
OC5H9 |
AB5C9 |
-97.17 |
3.2 |
-8.83 |
1.27 |
0 |
|
|
311879 |
126598696 |
1 |
OSN5C28H31 |
ABC5D28E31 |
88.69 |
5.78 |
-8.14 |
-0.68 |
0 |
|
|
311880 |
126598703 |
1 |
F2N2O3H24C27 |
A2B2C3D24E27 |
-104.87 |
7.42 |
-8.38 |
-1.09 |
0 |
|
|
311881 |
126598704 |
1 |
N3C16H31 |
A3B16C31 |
-23.53 |
1.99 |
-8.53 |
2.6 |
0 |
|
|
311882 |
126598706 |
1 |
N2F3O3H11C14 |
A2B3C3D11E14 |
-232.28 |
5.89 |
-9.44 |
-0.91 |
0 |
|
|
311883 |
126598708 |
1 |
F3O3N4H17C22 |
A3B3C4D17E22 |
-182.34 |
5.5 |
-8.85 |
-1.11 |
0 |
|
|
311884 |
126598748 |
1 |
ON2C35H52 |
AB2C35D52 |
-89.06 |
4.32 |
-8.95 |
0.5 |
0 |
|
|
311885 |
126598749 |
1 |
F3O3N4H17C22 |
A3B3C4D17E22 |
-172.47 |
2.46 |
-8.99 |
-1.28 |
0 |
|
|
311886 |
126598800 |
1 |
N2F3O6H25C26 |
A2B3C6D25E26 |
-352.75 |
8.79 |
-9.04 |
-1.02 |
0 |
|
|
311887 |
126598845 |
1 |
N2H40C45 |
A2B40C45 |
122.81 |
2.91 |
-7.97 |
-0.42 |
0 |
|
|
311888 |
126598854 |
1 |
N2H42C49 |
A2B42C49 |
140.78 |
1.43 |
-7.86 |
-0.63 |
0 |
|
|
311889 |
126598888 |
1 |
O2C13H18 |
A2B13C18 |
-59.23 |
3.81 |
-8.88 |
0.12 |
0 |
|
|
311890 |
126598889 |
1 |
N3O5H19C21 |
A3B5C19D21 |
-93.64 |
7.04 |
-8.9 |
-1.1 |
0 |
|
|
311891 |
126598900 |
1 |
F3N3O5H22C25 |
A3B3C5D22E25 |
-245.84 |
4.13 |
-8.7 |
-0.87 |
0 |