List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
328855 |
126728370 |
1 |
SO2N5C29H31 |
AB2C5D29E31 |
-11.23 |
6.4 |
-8.96 |
-1.59 |
0 |
|
|
328856 |
126728371 |
1 |
NSO2H13C14 |
ABC2D13E14 |
6.88 |
6.47 |
-8.1 |
-1.09 |
0 |
|
|
328857 |
126728372 |
1 |
SO2N5C23H29 |
AB2C5D23E29 |
-29.13 |
2.97 |
-8.99 |
-1.53 |
0 |
|
|
328858 |
126728381 |
1 |
NSO3H11C14 |
ABC3D11E14 |
-34.23 |
15.61 |
-8.02 |
-1.5 |
0 |
|
|
328859 |
126728389 |
1 |
NSO5H11C16 |
ABC5D11E16 |
-104.05 |
17.97 |
-8.25 |
-1.77 |
0 |
|
|
328860 |
126728390 |
1 |
SO5C17H34 |
AB5C17D34 |
-289.28 |
6.89 |
-11.1 |
0.01 |
0 |
|
|
328861 |
126728393 |
1 |
SN2O3H10C13 |
AB2C3D10E13 |
-7.17 |
2.61 |
-8.73 |
-1.73 |
0 |
|
|
328862 |
126728396 |
1 |
SO2N5C26H29 |
AB2C5D26E29 |
-20.69 |
6.01 |
-8.81 |
-1.2 |
0 |
|
|
328863 |
126728400 |
1 |
ON2F3C19H21 |
AB2C3D19E21 |
-166.12 |
5.28 |
-9.13 |
-0.37 |
0 |
|
|
328864 |
126728408 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-89.83 |
4.43 |
-9.02 |
0.96 |
0 |
|
|
328865 |
126728412 |
1 |
SO2N5C15H21 |
AB2C5D15E21 |
-61.44 |
5.52 |
-8.77 |
-1.16 |
0 |
|
|
328866 |
126728430 |
1 |
OSN6C26H28 |
ABC6D26E28 |
55.0 |
3.22 |
-9.02 |
-0.67 |
0 |
|
|
328867 |
126728432 |
1 |
O3F6C30H46 |
A3B6C30D46 |
-472.4 |
8.05 |
-10.02 |
0.54 |
0 |
|
|
328868 |
126728438 |
1 |
SO2N5C25H27 |
AB2C5D25E27 |
-4.96 |
2.24 |
-8.81 |
-1.57 |
0 |
|
|
328869 |
126728439 |
1 |
FSO2N5C22H26 |
ABC2D5E22F26 |
-71.77 |
2.21 |
-9.07 |
-1.76 |
0 |
|
|
328870 |
126728444 |
1 |
FSO2N5C26H28 |
ABC2D5E26F28 |
-75.26 |
1.52 |
-9.04 |
-0.81 |
0 |
|
|
328871 |
126728459 |
2 |
OSN3C12H13 |
ABC3D12E13 |
9.07 |
5.36 |
-8.78 |
-1.35 |
0 |
|
|
328872 |
126728462 |
1 |
BrClON2H10C12 |
ABCD2E10F12 |
11.83 |
8.83 |
-9.42 |
-0.97 |
0 |
|
|
328873 |
126728467 |
1 |
SO2F3N5H28C29 |
AB2C3D5E28F29 |
-150.03 |
4.5 |
-9.08 |
-1.69 |
0 |
|
|
328874 |
126728468 |
1 |
FNC17H20 |
ABC17D20 |
-30.25 |
3.13 |
-8.91 |
-0.6 |
0 |
|
|
328875 |
126728469 |
1 |
SO2N5C23H29 |
AB2C5D23E29 |
-12.37 |
3.18 |
-9.06 |
-0.88 |
0 |
|
|
328876 |
126728470 |
1 |
FSN2H9C10 |
ABC2D9E10 |
15.4 |
3.31 |
-9.09 |
-0.87 |
0 |
|
|
328877 |
126728623 |
1 |
S2N3O4H15C25 |
A2B3C4D15E25 |
3.96 |
4.06 |
-8.79 |
-1.74 |
0 |
|
|
328878 |
126728624 |
1 |
SN3O4H17C27 |
AB3C4D17E27 |
-5.36 |
4.91 |
-8.91 |
-1.77 |
0 |
|
|
328879 |
126728625 |
1 |
S2N3O4H15C25 |
A2B3C4D15E25 |
5.74 |
3.08 |
-8.66 |
-1.76 |
0 |
|
|
328880 |
126728628 |
1 |
NOC11H11 |
ABC11D11 |
5.8 |
1.25 |
-8.78 |
-0.44 |
0 |
|
|
328881 |
126728657 |
1 |
OC17H28 |
AB17C28 |
-30.73 |
1.22 |
-9.14 |
1.34 |
0 |
|
|
328882 |
126728661 |
1 |
BrN2O2C5H9 |
AB2C2D5E9 |
-77.1 |
1.98 |
-10.35 |
-0.4 |
0 |
|
|
328883 |
126728702 |
1 |
SN3O4H23C28 |
AB3C4D23E28 |
-8.73 |
5.72 |
-9.19 |
-1.26 |
0 |
|
|
328884 |
126728727 |
1 |
ClN5O7C21H28 |
AB5C7D21E28 |
-313.41 |
10.62 |
-8.98 |
-0.74 |
0 |
|
|
328885 |
126728734 |
1 |
NO8C22H39 |
AB8C22D39 |
-355.37 |
2.97 |
-11.02 |
-0.74 |
0 |
|
|
328886 |
126728735 |
1 |
NO7C12H21 |
AB7C12D21 |
-352.23 |
6.84 |
-10.78 |
0.0 |
0 |
|
|
328887 |
126728770 |
1 |
ClNO4C26H34 |
ABC4D26E34 |
-87.27 |
5.01 |
-7.14 |
-1.6 |
0 |
|
|
328888 |
126728774 |
1 |
O3N6C34H38 |
A3B6C34D38 |
1.94 |
3.14 |
-8.29 |
-0.25 |
0 |
|
|
328889 |
126728775 |
1 |
ClO2N6C26H29 |
AB2C6D26E29 |
32.07 |
3.0 |
-8.5 |
-0.32 |
0 |
|
|
328890 |
126728797 |
1 |
FC6H11 |
AB6C11 |
-63.49 |
1.37 |
-9.84 |
1.15 |
0 |
|
|
328891 |
126728811 |
1 |
O3C16H30 |
A3B16C30 |
-210.33 |
2.21 |
-10.16 |
1.98 |
0 |
|
|
328892 |
126728819 |
1 |
SN3C11H15 |
AB3C11D15 |
48.38 |
1.9 |
-8.88 |
-0.42 |
0 |
|
|
328893 |
126728827 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-107.41 |
7.06 |
-8.79 |
-0.47 |
0 |
|
|
328894 |
126728851 |
1 |
O2N5C31H37 |
A2B5C31D37 |
2.03 |
4.39 |
-8.36 |
0.08 |
0 |
|
|
328895 |
126728901 |
1 |
ClOSH15C21 |
ABCD15E21 |
17.65 |
2.79 |
-8.34 |
-0.79 |
0 |
|
|
328896 |
126728903 |
2 |
OH14C18 |
AB14C18 |
37.97 |
1.87 |
-8.49 |
-0.65 |
0 |
|
|
328897 |
126728940 |
1 |
F3N6O20H91C93 |
A3B6C20D91E93 |
-708.37 |
5.96 |
-8.62 |
-1.13 |
0 |
|
|
328899 |
126728966 |
1 |
N3O12H31C34 |
A3B12C31D34 |
-383.3 |
8.73 |
-9.58 |
-1.94 |
0 |
|
|
328900 |
126728974 |
1 |
F3N6O31C98H105 |
A3B6C31D98E105 |
-1189.05 |
8.35 |
-8.86 |
-1.08 |
0 |
|
|
328901 |
126728980 |
1 |
Br2H38C45 |
A2B38C45 |
108.98 |
2.05 |
-8.38 |
-0.71 |
0 |
|
|
328902 |
126729002 |
1 |
O2F9C17H25 |
A2B9C17D25 |
-606.52 |
4.39 |
-10.89 |
-0.1 |
0 |
|
|
328903 |
126729042 |
1 |
O4C11H20 |
A4B11C20 |
-219.97 |
1.75 |
-10.0 |
0.98 |
0 |
|
|
328904 |
126729047 |
1 |
F2N4O8C25H34 |
A2B4C8D25E34 |
-452.54 |
10.96 |
-9.93 |
-0.88 |
0 |
|
|
328905 |
126729061 |
1 |
OSN2H30C43 |
ABC2D30E43 |
142.98 |
3.33 |
-8.23 |
-0.88 |
0 |