List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
58881 |
24715029 |
1 |
O2N3H13C19 |
A2B3C13D19 |
49.52 |
3.59 |
-9.47 |
-1.78 |
0 |
|
|
58882 |
24715032 |
1 |
NO3C17H19 |
AB3C17D19 |
-42.03 |
1.71 |
-9.28 |
-0.55 |
0 |
|
|
58883 |
24715033 |
1 |
FNO4C17H20 |
ABC4D17E20 |
-149.92 |
1.51 |
-9.33 |
-0.51 |
0 |
|
|
58884 |
24715034 |
1 |
NO4C18H23 |
AB4C18D23 |
-113.7 |
3.08 |
-9.18 |
-0.47 |
0 |
|
|
58885 |
24715035 |
1 |
FNO4C18H22 |
ABC4D18E22 |
-158.87 |
2.0 |
-9.32 |
-0.66 |
0 |
|
|
58886 |
24715038 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-56.52 |
4.33 |
-8.53 |
-0.7 |
0 |
|
|
58887 |
24715039 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-88.81 |
7.28 |
-9.45 |
-0.29 |
0 |
|
|
58888 |
24715042 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-66.75 |
5.02 |
-8.78 |
-0.62 |
0 |
|
|
58889 |
24715045 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-20.16 |
6.04 |
-8.92 |
-0.47 |
0 |
|
|
58890 |
24715046 |
1 |
N2O3C17H20 |
A2B3C17D20 |
-96.42 |
9.49 |
-9.56 |
-0.27 |
0 |
|
|
58891 |
24715047 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-76.05 |
4.16 |
-9.01 |
-0.01 |
0 |
|
|
58892 |
24715053 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-93.95 |
6.55 |
-9.09 |
0.0 |
0 |
|
|
58893 |
24715056 |
1 |
OSF2N3H13C14 |
ABC2D3E13F14 |
-61.4 |
3.68 |
-9.08 |
-0.88 |
0 |
|
|
58894 |
24715061 |
1 |
ION3C12H14 |
ABC3D12E14 |
-10.05 |
5.17 |
-8.83 |
-0.81 |
0 |
|
|
58895 |
24715145 |
1 |
O2F3N3H14C16 |
A2B3C3D14E16 |
-163.11 |
3.27 |
-9.74 |
-1.36 |
0 |
|
|
58896 |
24715150 |
1 |
SN3O3C14H21 |
AB3C3D14E21 |
-99.37 |
2.99 |
-9.33 |
-0.66 |
0 |
|
|
58897 |
24715151 |
1 |
FNC11H16 |
ABC11D16 |
-43.84 |
3.3 |
-9.12 |
0.16 |
0 |
|
|
58898 |
24715152 |
2 |
ON2C7H7 |
AB2C7D7 |
-8.75 |
3.06 |
-8.53 |
-1.11 |
0 |
|
|
58899 |
24715155 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-87.49 |
5.38 |
-8.86 |
-0.39 |
0 |
|
|
58900 |
24715184 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-27.5 |
6.14 |
-9.26 |
-0.32 |
0 |
|
|
58901 |
24715198 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-25.36 |
5.35 |
-8.93 |
-1.02 |
0 |
|
|
58902 |
24715207 |
1 |
OSN3C18H25 |
ABC3D18E25 |
-21.24 |
2.5 |
-8.55 |
-0.62 |
0 |
|
|
58903 |
24715266 |
1 |
ON2C14H18 |
AB2C14D18 |
33.85 |
3.74 |
-8.91 |
-0.37 |
0 |
|
|
58904 |
24715267 |
1 |
OF2N2H16C17 |
AB2C2D16E17 |
-43.9 |
4.26 |
-9.17 |
-0.62 |
0 |
|
|
58905 |
24715297 |
1 |
FO2N3H12C19 |
AB2C3D12E19 |
3.2 |
4.38 |
-9.41 |
-1.79 |
0 |
|
|
58906 |
24715340 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-82.28 |
1.82 |
-8.69 |
-0.32 |
0 |
|
|
58907 |
24715422 |
1 |
FO2N3H12C13 |
AB2C3D12E13 |
-72.27 |
4.91 |
-9.56 |
-0.35 |
0 |
|
|
58908 |
24715472 |
1 |
FNSO3C12H12 |
ABCD3E12F12 |
-156.15 |
5.01 |
-9.47 |
-0.75 |
0 |
|
|
58909 |
24715473 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-106.88 |
3.18 |
-8.27 |
-0.2 |
0 |
|
|
58910 |
24715631 |
2 |
NOC7H13 |
ABC7D13 |
-87.21 |
2.38 |
-8.6 |
1.16 |
0 |
|
|
58911 |
24715632 |
1 |
SN2O2C14H20 |
AB2C2D14E20 |
-64.44 |
1.48 |
-8.88 |
-0.28 |
0 |
|
|
58912 |
24715633 |
1 |
ClNSO3C12H12 |
ABCD3E12F12 |
-117.06 |
3.58 |
-9.56 |
-0.9 |
0 |
|
|
58913 |
24715685 |
1 |
FO2N4C17H17 |
AB2C4D17E17 |
-37.12 |
7.3 |
-9.53 |
-0.59 |
0 |
|
|
58914 |
24715692 |
1 |
FO2N4C17H17 |
AB2C4D17E17 |
-39.67 |
9.42 |
-8.86 |
-0.72 |
0 |
|
|
58915 |
24715693 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-11.15 |
7.15 |
-8.42 |
-0.6 |
0 |
|
|
58916 |
24716159 |
2 |
NO2C8H9 |
AB2C8D9 |
-106.75 |
1.21 |
-8.62 |
-0.23 |
0 |
|
|
58917 |
24716160 |
1 |
ClN2O3C17H17 |
AB2C3D17E17 |
-75.43 |
1.49 |
-9.39 |
-0.54 |
0 |
|
|
58918 |
24716163 |
2 |
NO2C8H11 |
AB2C8D11 |
-145.05 |
1.22 |
-8.44 |
0.08 |
0 |
|
|
58919 |
24716191 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-121.63 |
1.79 |
-8.52 |
0.03 |
0 |
|
|
58920 |
24716225 |
1 |
N2O5C16H22 |
A2B5C16D22 |
-177.47 |
4.23 |
-8.33 |
-0.12 |
0 |
|
|
58921 |
24716228 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-116.87 |
1.59 |
-9.03 |
0.17 |
0 |
|
|
58922 |
24716361 |
2 |
NO2C7H8 |
AB2C7D8 |
-130.38 |
1.06 |
-8.64 |
-0.26 |
0 |
|
|
58923 |
24716663 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-101.59 |
1.28 |
-9.05 |
0.22 |
0 |
|
|
58924 |
24717538 |
1 |
O3N4C34H40 |
A3B4C34D40 |
-78.46 |
4.29 |
-8.73 |
-0.28 |
0 |
|
|
58925 |
24717848 |
1 |
ClN2O3C24H31 |
AB2C3D24E31 |
-97.1 |
4.78 |
-8.09 |
-0.4 |
0 |
|
|
58926 |
24718510 |
1 |
FON3C24H26 |
ABC3D24E26 |
-41.67 |
1.99 |
-8.64 |
-0.09 |
0 |
|
|
58927 |
24718583 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-32.12 |
7.53 |
-9.01 |
-0.82 |
0 |
|
|
58928 |
24718584 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-85.8 |
6.17 |
-9.02 |
-0.75 |
0 |
|
|
58929 |
24719448 |
1 |
ClO2N6C19H25 |
AB2C6D19E25 |
-37.97 |
7.12 |
-8.68 |
-1.06 |
0 |
|
|
58930 |
24719926 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-97.35 |
4.94 |
-8.99 |
0.28 |
0 |