List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
449328 |
135297644 |
1 |
F2O2N5H21C24 |
A2B2C5D21E24 |
-32.75 |
6.67 |
-9.84 |
-0.99 |
0 |
|
|
449329 |
135297656 |
1 |
F2O2N5C26H31 |
A2B2C5D26E31 |
-107.14 |
5.97 |
-9.12 |
-0.8 |
0 |
|
|
449330 |
135297664 |
1 |
OF2N5C25H25 |
AB2C5D25E25 |
-21.36 |
3.28 |
-8.61 |
-0.57 |
0 |
|
|
449332 |
135297678 |
1 |
N2O2C11H16 |
A2B2C11D16 |
-74.47 |
5.66 |
-9.37 |
-0.28 |
0 |
|
|
449333 |
135297695 |
2 |
FON2C14H15 |
ABC2D14E15 |
-40.44 |
6.78 |
-9.15 |
-0.82 |
0 |
|
|
449334 |
135297747 |
1 |
OF2N7C27H29 |
AB2C7D27E29 |
-6.22 |
3.75 |
-9.82 |
-0.82 |
0 |
|
|
449335 |
135297752 |
1 |
F2O2N5C30H37 |
A2B2C5D30E37 |
-111.96 |
6.74 |
-9.46 |
-0.7 |
0 |
|
|
449336 |
135297755 |
1 |
OF2N5C32H37 |
AB2C5D32E37 |
-46.46 |
3.73 |
-9.73 |
-1.06 |
0 |
|
|
449337 |
135297760 |
1 |
OF2N7C27H27 |
AB2C7D27E27 |
2.89 |
5.36 |
-9.35 |
-0.86 |
0 |
|
|
449339 |
135297767 |
1 |
OF2N6C28H30 |
AB2C6D28E30 |
-20.62 |
5.5 |
-9.1 |
-0.74 |
0 |
|
|
449340 |
135297770 |
1 |
OF2N4C24H24 |
AB2C4D24E24 |
-57.52 |
6.14 |
-9.81 |
-0.79 |
0 |
|
|
449341 |
135297771 |
1 |
OF2N6C26H28 |
AB2C6D26E28 |
-7.12 |
5.59 |
-9.23 |
-1.17 |
0 |
|
|
449342 |
135297773 |
2 |
FON3C14H14 |
ABC3D14E14 |
-26.69 |
2.84 |
-9.71 |
-0.61 |
0 |
|
|
449343 |
135297815 |
1 |
F2N7H23C24 |
A2B7C23D24 |
63.65 |
5.09 |
-9.53 |
-0.89 |
0 |
|
|
449344 |
135297820 |
1 |
FO2N5C25H26 |
AB2C5D25E26 |
-22.19 |
7.14 |
-9.75 |
-0.96 |
0 |
|
|
449345 |
135297823 |
1 |
F2O2N5H23C26 |
A2B2C5D23E26 |
-24.56 |
6.1 |
-9.67 |
-1.28 |
0 |
|
|
449347 |
135297839 |
2 |
NOC7H14 |
ABC7D14 |
-123.22 |
3.03 |
-9.26 |
1.37 |
0 |
|
|
449348 |
135297845 |
1 |
NO2C17H31 |
AB2C17D31 |
-92.4 |
3.24 |
-9.18 |
-0.23 |
0 |
|
|
449349 |
135297860 |
1 |
N2O11C36H38 |
A2B11C36D38 |
-383.26 |
2.94 |
-8.3 |
-1.68 |
0 |
|
|
449350 |
135297861 |
1 |
N2O9C39H42 |
A2B9C39D42 |
-289.16 |
4.29 |
-8.17 |
-1.72 |
0 |
|
|
449351 |
135297872 |
2 |
FN3C13H13 |
AB3C13D13 |
38.69 |
6.39 |
-9.31 |
-0.74 |
0 |
|
|
449352 |
135297873 |
1 |
OF2N5H25C26 |
AB2C5D25E26 |
-8.93 |
4.64 |
-9.52 |
-0.72 |
0 |
|
|
449353 |
135297874 |
1 |
FN6O8C30H35 |
AB6C8D30E35 |
-246.15 |
7.57 |
-9.31 |
-0.7 |
0 |
|
|
449354 |
135297894 |
4 |
OC6H8 |
AB6C8 |
-165.9 |
2.62 |
-9.06 |
-0.4 |
0 |
|
|
449355 |
135297899 |
1 |
O4C29H42 |
A4B29C42 |
-185.0 |
3.02 |
-9.14 |
-0.42 |
0 |
|
|
449356 |
135297905 |
1 |
IO4C22H27 |
AB4C22D27 |
-133.71 |
2.41 |
-9.16 |
-0.91 |
0 |
|
|
449357 |
135297917 |
4 |
OC7H10 |
AB7C10 |
-180.95 |
1.58 |
-8.98 |
-0.66 |
0 |
|
|
449358 |
135297929 |
1 |
O5C28H40 |
A5B28C40 |
-221.32 |
3.95 |
-9.25 |
-0.72 |
0 |
|
|
449359 |
135297930 |
1 |
O6C33H50 |
A6B33C50 |
-284.45 |
4.26 |
-9.03 |
-0.69 |
0 |
|
|
449360 |
135297955 |
1 |
OBr2C30H40 |
AB2C30D40 |
-58.73 |
3.07 |
-9.24 |
-1.13 |
0 |
|
|
449361 |
135297958 |
1 |
NOBr2C38H41 |
ABC2D38E41 |
2.97 |
2.65 |
-9.01 |
-1.15 |
0 |
|
|
449362 |
135297964 |
1 |
OF2N6C30H34 |
AB2C6D30E34 |
-37.94 |
5.79 |
-9.74 |
-1.21 |
0 |
|
|
449363 |
135297982 |
1 |
N2O2C31H34 |
A2B2C31D34 |
77.74 |
3.74 |
-8.4 |
-0.68 |
0 |
|
|
449364 |
135297988 |
1 |
FSN7H16C21 |
ABC7D16E21 |
165.03 |
10.86 |
-8.7 |
-2.31 |
0 |
|
|
449365 |
135297992 |
1 |
FN8H17C24 |
AB8C17D24 |
175.25 |
10.69 |
-8.69 |
-2.24 |
0 |
|
|
449366 |
135298009 |
1 |
FON8H27C30 |
ABC8D27E30 |
100.3 |
13.3 |
-8.68 |
-2.24 |
0 |
|
|
449367 |
135298013 |
1 |
FON8H27C31 |
ABC8D27E31 |
107.75 |
13.39 |
-8.69 |
-2.25 |
0 |
|
|
449368 |
135298017 |
1 |
FN8H15C23 |
AB8C15D23 |
187.16 |
7.98 |
-8.84 |
-2.4 |
0 |
|
|
449369 |
135298037 |
1 |
ON8H26C29 |
AB8C26D29 |
157.75 |
10.27 |
-8.56 |
-2.14 |
0 |
|
|
449370 |
135298048 |
1 |
N8H24C27 |
A8B24C27 |
208.47 |
11.67 |
-8.54 |
-2.15 |
0 |
|
|
449371 |
135298051 |
1 |
ON8H28C30 |
AB8C28D30 |
150.44 |
10.42 |
-8.55 |
-2.14 |
0 |
|
|
449372 |
135298054 |
1 |
ON8H28C31 |
AB8C28D31 |
158.66 |
10.63 |
-8.55 |
-2.13 |
0 |
|
|
449373 |
135298086 |
1 |
ON2C9H18 |
AB2C9D18 |
-67.96 |
4.19 |
-9.09 |
1.48 |
0 |
|
|
449374 |
135298095 |
1 |
ClFO2N6C29H32 |
ABC2D6E29F32 |
-13.48 |
4.28 |
-8.42 |
-1.03 |
0 |
|
|
449375 |
135298103 |
1 |
ClFO3N4H26C27 |
ABC3D4E26F27 |
-60.14 |
4.7 |
-8.31 |
-1.12 |
0 |
|
|
449376 |
135298112 |
1 |
ClFO2N5C30H33 |
ABC2D5E30F33 |
-21.36 |
1.77 |
-8.52 |
-1.23 |
0 |
|
|
449377 |
135298114 |
1 |
ClFO2N5C28H29 |
ABC2D5E28F29 |
-9.9 |
5.44 |
-8.36 |
-0.91 |
0 |
|
|
449378 |
135298117 |
1 |
OCl2N6C26H26 |
AB2C6D26E26 |
80.56 |
1.2 |
-8.37 |
-0.92 |
0 |
|
|
449379 |
135298127 |
1 |
ClFO3N4C28H28 |
ABC3D4E28F28 |
-62.84 |
3.76 |
-8.32 |
-1.1 |
0 |
|
|
449380 |
135298128 |
1 |
OCl2N5C27H27 |
AB2C5D27E27 |
66.95 |
2.84 |
-8.38 |
-0.97 |
0 |