List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
330481 |
127247888 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-99.56 |
3.97 |
-8.86 |
0.1 |
0 |
|
|
330482 |
127247889 |
1 |
FO2N3C19H28 |
AB2C3D19E28 |
-115.14 |
4.61 |
-8.87 |
-0.04 |
0 |
|
|
330483 |
127247890 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-65.31 |
5.63 |
-8.76 |
-0.45 |
0 |
|
|
330484 |
127247891 |
1 |
SO2N3C13H19 |
AB2C3D13E19 |
-53.84 |
3.47 |
-8.92 |
-0.59 |
0 |
|
|
330485 |
127247892 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-70.81 |
2.96 |
-8.8 |
-0.06 |
0 |
|
|
330486 |
127247893 |
1 |
O2N5C14H23 |
A2B5C14D23 |
-52.54 |
5.03 |
-8.78 |
0.12 |
0 |
|
|
330487 |
127247894 |
1 |
SN4O4C11H22 |
AB4C4D11E22 |
-175.24 |
9.1 |
-8.69 |
-0.05 |
0 |
|
|
330488 |
127247895 |
1 |
O2N5C15H25 |
A2B5C15D25 |
-52.11 |
5.41 |
-8.7 |
0.15 |
0 |
|
|
330489 |
127247896 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-168.06 |
4.41 |
-9.06 |
0.48 |
0 |
|
|
330490 |
127247897 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-72.41 |
4.38 |
-8.92 |
0.0 |
0 |
|
|
330491 |
127247898 |
1 |
OF3N4C14H19 |
AB3C4D14E19 |
-176.72 |
4.8 |
-8.92 |
-0.54 |
0 |
|
|
330492 |
127247899 |
1 |
O3N5C15H23 |
A3B5C15D23 |
-89.7 |
4.26 |
-8.84 |
-0.82 |
0 |
|
|
330493 |
127247900 |
1 |
O2N5C16H27 |
A2B5C16D27 |
-63.07 |
6.57 |
-8.63 |
0.01 |
0 |
|
|
330494 |
127247901 |
1 |
O3N4C16H26 |
A3B4C16D26 |
-93.75 |
3.66 |
-8.93 |
0.2 |
0 |
|
|
330495 |
127247902 |
1 |
F2O2N3C16H21 |
A2B2C3D16E21 |
-161.99 |
7.89 |
-9.21 |
-0.16 |
0 |
|
|
330496 |
127247903 |
1 |
ClFO2N3C15H19 |
ABC2D3E15F19 |
-116.1 |
4.12 |
-9.07 |
-0.79 |
0 |
|
|
330497 |
127247904 |
1 |
ClO3N4C14H21 |
AB3C4D14E21 |
-80.25 |
3.74 |
-9.07 |
-0.52 |
0 |
|
|
330498 |
127247905 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-86.08 |
3.64 |
-8.89 |
-0.7 |
0 |
|
|
330499 |
127247906 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-81.38 |
2.82 |
-8.88 |
0.49 |
0 |
|
|
330500 |
127247907 |
3 |
NOC6H9 |
ABC6D9 |
-121.47 |
3.06 |
-8.76 |
0.41 |
0 |
|
|
330501 |
127247908 |
3 |
NOC6H9 |
ABC6D9 |
-119.4 |
3.35 |
-8.62 |
0.15 |
0 |
|
|
330502 |
127247909 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-54.21 |
1.98 |
-8.88 |
-0.5 |
0 |
|
|
330503 |
127247910 |
1 |
O2N5C17H29 |
A2B5C17D29 |
-76.88 |
4.16 |
-8.72 |
0.55 |
0 |
|
|
330504 |
127247911 |
1 |
SO2N3C17H25 |
AB2C3D17E25 |
-74.34 |
2.18 |
-8.95 |
-0.32 |
0 |
|
|
330505 |
127247912 |
1 |
O3N5C16H27 |
A3B5C16D27 |
-87.85 |
3.54 |
-8.96 |
-0.38 |
0 |
|
|
330506 |
127247913 |
1 |
O3N5C16H27 |
A3B5C16D27 |
-103.87 |
2.76 |
-8.92 |
-0.18 |
0 |
|
|
330507 |
127247914 |
1 |
O4N5C15H25 |
A4B5C15D25 |
-178.45 |
4.6 |
-8.75 |
-0.09 |
0 |
|
|
330508 |
127247915 |
1 |
ClFO2N3C16H21 |
ABC2D3E16F21 |
-125.34 |
6.2 |
-9.09 |
-0.42 |
0 |
|
|
330509 |
127247916 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-59.34 |
7.43 |
-8.58 |
-0.24 |
0 |
|
|
330510 |
127247917 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-51.41 |
7.71 |
-8.62 |
-0.24 |
0 |
|
|
330511 |
127247918 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-93.48 |
3.8 |
-8.86 |
-0.27 |
0 |
|
|
330512 |
127247919 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-32.4 |
2.03 |
-8.81 |
-0.28 |
0 |
|
|
330513 |
127247920 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-44.6 |
6.34 |
-8.6 |
-0.3 |
0 |
|
|
330514 |
127247921 |
1 |
O2N6C17H24 |
A2B6C17D24 |
-19.27 |
8.26 |
-8.69 |
-1.02 |
0 |
|
|
330515 |
127247922 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-68.5 |
3.41 |
-8.43 |
0.21 |
0 |
|
|
330516 |
127247923 |
1 |
N4O4C17H22 |
A4B4C17D22 |
-130.41 |
4.54 |
-9.02 |
-0.6 |
0 |
|
|
330517 |
127247924 |
1 |
FO2N4C18H23 |
AB2C4D18E23 |
-92.72 |
2.7 |
-8.93 |
-0.94 |
0 |
|
|
330518 |
127247925 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-83.5 |
4.1 |
-8.86 |
-0.95 |
0 |
|
|
330519 |
127247926 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-95.16 |
2.69 |
-8.8 |
0.99 |
0 |
|
|
330520 |
127247927 |
1 |
O3N4C12H22 |
A3B4C12D22 |
-139.31 |
3.65 |
-9.32 |
0.8 |
0 |
|
|
330521 |
127247928 |
1 |
O2N5C13H21 |
A2B5C13D21 |
-56.32 |
9.89 |
-9.2 |
0.69 |
0 |
|
|
330522 |
127247929 |
1 |
SO2N4C13H20 |
AB2C4D13E20 |
-55.82 |
1.44 |
-9.2 |
-0.5 |
0 |
|
|
330523 |
127247930 |
1 |
SN3O3C14H19 |
AB3C3D14E19 |
-99.75 |
9.34 |
-9.32 |
-0.67 |
0 |
|
|
330524 |
127247931 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-122.44 |
1.12 |
-9.39 |
-0.15 |
0 |
|
|
330525 |
127247932 |
1 |
N4O4C15H24 |
A4B4C15D24 |
-187.46 |
4.01 |
-9.59 |
0.2 |
0 |
|
|
330526 |
127247933 |
1 |
O3N4C16H28 |
A3B4C16D28 |
-150.73 |
6.39 |
-9.14 |
0.63 |
0 |
|
|
330527 |
127247934 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-128.78 |
2.35 |
-9.36 |
0.1 |
0 |
|
|
330528 |
127247935 |
1 |
SN3O4C14H25 |
AB3C4D14E25 |
-187.25 |
6.04 |
-9.57 |
0.27 |
0 |
|
|
330529 |
127247936 |
1 |
N3O4C17H23 |
A3B4C17D23 |
-147.93 |
7.59 |
-9.23 |
-0.62 |
0 |
|
|
330530 |
127247937 |
1 |
FN3O3C17H24 |
AB3C3D17E24 |
-150.2 |
5.48 |
-8.97 |
-0.17 |
0 |