List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
55851 |
17396683 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-68.42 |
6.28 |
-8.89 |
0.25 |
0 |
|
|
55852 |
17396688 |
1 |
NO2C17H17 |
AB2C17D17 |
-42.97 |
5.26 |
-9.54 |
-0.98 |
0 |
|
|
55853 |
17396692 |
1 |
NO2C15H15 |
AB2C15D15 |
-52.8 |
3.29 |
-8.62 |
-0.04 |
0 |
|
|
55854 |
17396694 |
1 |
NO4C15H15 |
AB4C15D15 |
-110.67 |
4.42 |
-8.51 |
-0.4 |
0 |
|
|
55855 |
17396695 |
1 |
NO2F3H12C15 |
AB2C3D12E15 |
-205.81 |
2.38 |
-8.87 |
-1.0 |
0 |
|
|
55856 |
17396696 |
1 |
FN2O3H15C19 |
AB2C3D15E19 |
-97.38 |
2.71 |
-9.43 |
-0.69 |
0 |
|
|
55857 |
17396698 |
1 |
OCl2N3H15C17 |
AB2C3D15E17 |
0.77 |
6.59 |
-9.23 |
-0.42 |
0 |
|
|
55858 |
17396700 |
1 |
ON3C18H19 |
AB3C18D19 |
5.93 |
3.59 |
-9.12 |
-0.3 |
0 |
|
|
55859 |
17396702 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
-52.78 |
3.45 |
-8.91 |
-1.03 |
0 |
|
|
55860 |
17396709 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-84.3 |
3.46 |
-9.21 |
-0.67 |
0 |
|
|
55861 |
17396718 |
1 |
N3O4C23H23 |
A3B4C23D23 |
-93.74 |
3.65 |
-8.73 |
-0.38 |
0 |
|
|
55862 |
17396720 |
1 |
ClF2N2O2H9C13 |
AB2C2D2E9F13 |
-134.7 |
1.53 |
-9.17 |
-1.32 |
0 |
|
|
55863 |
17396721 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-76.04 |
3.47 |
-8.68 |
-0.76 |
0 |
|
|
55864 |
17396729 |
1 |
FO2N4H17C18 |
AB2C4D17E18 |
-23.81 |
6.43 |
-9.66 |
-0.84 |
0 |
|
|
55865 |
17396749 |
1 |
N2O3C21H24 |
A2B3C21D24 |
-101.32 |
4.69 |
-9.15 |
-0.51 |
0 |
|
|
55866 |
17396756 |
1 |
NO2F3H10C14 |
AB2C3D10E14 |
-195.6 |
5.36 |
-8.95 |
-1.23 |
0 |
|
|
55867 |
17396761 |
1 |
BrNO4C16H16 |
ABC4D16E16 |
-113.05 |
6.5 |
-8.65 |
-0.6 |
0 |
|
|
55868 |
17396768 |
1 |
NO2C16H17 |
AB2C16D17 |
-54.03 |
4.27 |
-8.58 |
-0.34 |
0 |
|
|
55869 |
17396769 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-74.07 |
2.17 |
-9.39 |
0.09 |
0 |
|
|
55870 |
17396783 |
1 |
NO4C16H17 |
AB4C16D17 |
-151.18 |
3.06 |
-9.07 |
-1.11 |
0 |
|
|
55871 |
17396788 |
1 |
NO4H17C18 |
AB4C17D18 |
-97.76 |
4.93 |
-9.51 |
-0.81 |
0 |
|
|
55872 |
17396846 |
1 |
OS2N3C13H15 |
AB2C3D13E15 |
18.71 |
2.85 |
-8.7 |
-1.12 |
0 |
|
|
55873 |
17396849 |
1 |
BrO2N4H13C14 |
AB2C4D13E14 |
-18.18 |
6.12 |
-8.81 |
-1.72 |
0 |
|
|
55874 |
17396859 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-122.79 |
2.31 |
-8.19 |
0.0 |
0 |
|
|
55875 |
17396860 |
1 |
OS2N4H16C18 |
AB2C4D16E18 |
71.16 |
5.42 |
-8.72 |
-1.57 |
0 |
|
|
55876 |
17396873 |
1 |
N3O3C20H23 |
A3B3C20D23 |
-71.78 |
3.86 |
-8.72 |
-0.36 |
0 |
|
|
55877 |
17396880 |
1 |
N2O5H18C20 |
A2B5C18D20 |
-151.99 |
6.56 |
-9.42 |
-1.28 |
0 |
|
|
55878 |
17396885 |
2 |
NO2C10H10 |
AB2C10D10 |
-99.82 |
2.55 |
-8.87 |
-0.94 |
0 |
|
|
55879 |
17396889 |
1 |
SN3O4H17C18 |
AB3C4D17E18 |
-95.1 |
1.66 |
-8.75 |
-0.98 |
0 |
|
|
55880 |
17396896 |
1 |
FN2O2H15C16 |
AB2C2D15E16 |
-98.37 |
5.17 |
-8.78 |
-0.56 |
0 |
|
|
55881 |
17396914 |
1 |
N2O2F3C19H19 |
A2B2C3D19E19 |
-218.69 |
3.95 |
-9.9 |
-0.61 |
0 |
|
|
55882 |
17396937 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-96.32 |
1.13 |
-9.47 |
0.04 |
0 |
|
|
55883 |
17396966 |
1 |
OSN3C16H17 |
ABC3D16E17 |
47.37 |
4.94 |
-8.66 |
-0.36 |
0 |
|
|
55884 |
17397006 |
1 |
NSF3O3C13H16 |
ABC3D3E13F16 |
-266.37 |
2.81 |
-9.6 |
-1.42 |
0 |
|
|
55885 |
17397007 |
1 |
ON2H16C18 |
AB2C16D18 |
44.14 |
6.78 |
-8.74 |
-0.52 |
0 |
|
|
55886 |
17397008 |
1 |
NSCl2O4H13C14 |
ABC2D4E13F14 |
-120.7 |
5.69 |
-8.88 |
-0.8 |
0 |
|
|
55887 |
17397009 |
1 |
NSF2O3C17H17 |
ABC2D3E17F17 |
-141.79 |
4.98 |
-8.85 |
-1.14 |
0 |
|
|
55888 |
17397057 |
1 |
BrSN2O2C15H15 |
ABC2D2E15F15 |
-25.78 |
1.17 |
-9.23 |
-1.1 |
0 |
|
|
55889 |
17397062 |
1 |
ClO3N4H11C15 |
AB3C4D11E15 |
8.86 |
1.72 |
-9.2 |
-1.05 |
0 |
|
|
55890 |
17397073 |
1 |
BrN2O4C13H13 |
AB2C4D13E13 |
-137.17 |
3.71 |
-9.92 |
-0.9 |
0 |
|
|
55891 |
17397096 |
3 |
NOH5C6 |
ABC5D6 |
-16.67 |
0.63 |
-8.78 |
-1.01 |
0 |
|
|
55892 |
17397104 |
1 |
OSN5C16H17 |
ABC5D16E17 |
49.03 |
2.15 |
-9.04 |
-1.07 |
0 |
|
|
55893 |
17397106 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-21.92 |
6.5 |
-8.45 |
-0.28 |
0 |
|
|
55894 |
17397128 |
1 |
BrFON2C17H18 |
ABCD2E17F18 |
-40.97 |
3.12 |
-8.97 |
-0.85 |
0 |
|
|
55895 |
17397194 |
1 |
ON5H15C19 |
AB5C15D19 |
88.83 |
3.88 |
-9.26 |
-1.01 |
0 |
|
|
55896 |
17397205 |
1 |
ClN3O4H18C20 |
AB3C4D18E20 |
-126.56 |
8.64 |
-9.09 |
-1.04 |
0 |
|
|
55897 |
17397212 |
1 |
N2F3O3H11C14 |
A2B3C3D11E14 |
-207.49 |
7.4 |
-9.16 |
-0.82 |
0 |
|
|
55898 |
17397222 |
1 |
N2O2F3C19H19 |
A2B2C3D19E19 |
-225.56 |
3.92 |
-9.03 |
-0.54 |
0 |
|
|
55899 |
17397229 |
1 |
SN2O2H14C16 |
AB2C2D14E16 |
-40.45 |
4.42 |
-8.92 |
-1.1 |
0 |
|
|
55900 |
17397233 |
1 |
ON2S2H16C17 |
AB2C2D16E17 |
30.12 |
4.85 |
-8.63 |
-1.2 |
0 |