List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
359838 |
127299882 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-6.51 |
3.68 |
-8.72 |
-0.23 |
0 |
|
|
359839 |
127299883 |
1 |
ON5C18H23 |
AB5C18D23 |
17.02 |
6.43 |
-8.85 |
-0.02 |
0 |
|
|
359840 |
127299884 |
1 |
O2N5C17H21 |
A2B5C17D21 |
-1.89 |
4.04 |
-8.88 |
-0.06 |
0 |
|
|
359841 |
127299885 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-21.43 |
1.68 |
-8.79 |
-0.01 |
0 |
|
|
359842 |
127299886 |
1 |
ON6C21H28 |
AB6C21D28 |
48.2 |
11.1 |
-8.36 |
0.14 |
0 |
|
|
359843 |
127299887 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-86.15 |
4.26 |
-8.74 |
0.03 |
0 |
|
|
359844 |
127299888 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-91.13 |
5.33 |
-8.71 |
0.07 |
0 |
|
|
359845 |
127299889 |
2 |
ON3C9H15 |
AB3C9D15 |
-25.41 |
5.16 |
-8.74 |
0.31 |
0 |
|
|
359846 |
127299890 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-15.53 |
2.61 |
-8.49 |
-0.43 |
0 |
|
|
359847 |
127299891 |
2 |
ON3C9H16 |
AB3C9D16 |
-52.69 |
7.24 |
-8.66 |
0.46 |
0 |
|
|
359848 |
127299892 |
2 |
ON3C10H14 |
AB3C10D14 |
1.61 |
4.67 |
-8.61 |
-0.8 |
0 |
|
|
359849 |
127299893 |
2 |
ON3C9H15 |
AB3C9D15 |
-51.02 |
5.71 |
-8.77 |
0.55 |
0 |
|
|
359850 |
127299894 |
1 |
O3N4C21H30 |
A3B4C21D30 |
-101.94 |
1.64 |
-8.69 |
0.06 |
0 |
|
|
359851 |
127299895 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-60.08 |
3.07 |
-8.73 |
-1.02 |
0 |
|
|
359852 |
127299896 |
1 |
O3N4C18H32 |
A3B4C18D32 |
-113.18 |
4.57 |
-8.56 |
0.7 |
0 |
|
|
359853 |
127299897 |
1 |
O3N4C21H38 |
A3B4C21D38 |
-150.48 |
5.32 |
-8.59 |
0.9 |
0 |
|
|
359854 |
127299898 |
1 |
O3N4C19H34 |
A3B4C19D34 |
-148.71 |
2.27 |
-8.59 |
0.71 |
0 |
|
|
359855 |
127299899 |
1 |
O3N6C19H28 |
A3B6C19D28 |
-63.36 |
4.85 |
-8.64 |
-0.78 |
0 |
|
|
359856 |
127299900 |
1 |
O4N5C17H29 |
A4B5C17D29 |
-168.77 |
2.75 |
-8.87 |
0.44 |
0 |
|
|
359857 |
127299901 |
1 |
O3N4C21H38 |
A3B4C21D38 |
-154.32 |
6.56 |
-8.57 |
0.67 |
0 |
|
|
359858 |
127299902 |
1 |
ClO3N5C18H26 |
AB3C5D18E26 |
-106.27 |
1.99 |
-9.07 |
-0.64 |
0 |
|
|
359859 |
127299903 |
1 |
O4N5C18H31 |
A4B5C18D31 |
-183.11 |
4.61 |
-8.63 |
0.0 |
0 |
|
|
359860 |
127299904 |
1 |
O3N4C17H30 |
A3B4C17D30 |
-120.37 |
3.54 |
-8.88 |
0.6 |
0 |
|
|
359861 |
127299905 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-25.41 |
3.14 |
-8.8 |
-0.63 |
0 |
|
|
359862 |
127299906 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-61.25 |
3.59 |
-8.63 |
-1.02 |
0 |
|
|
359863 |
127299907 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-91.29 |
5.65 |
-9.02 |
0.54 |
0 |
|
|
359864 |
127299908 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-86.9 |
7.56 |
-8.75 |
-0.69 |
0 |
|
|
359865 |
127299909 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-44.87 |
4.63 |
-8.69 |
-0.46 |
0 |
|
|
359866 |
127299910 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-123.62 |
6.59 |
-8.72 |
0.72 |
0 |
|
|
359867 |
127299911 |
1 |
O4N5C18H29 |
A4B5C18D29 |
-111.22 |
8.12 |
-8.84 |
-0.41 |
0 |
|
|
359868 |
127299912 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-11.71 |
7.13 |
-8.56 |
-0.9 |
0 |
|
|
359869 |
127299913 |
1 |
O3N4C20H36 |
A3B4C20D36 |
-156.88 |
5.32 |
-8.83 |
0.67 |
0 |
|
|
359870 |
127299914 |
1 |
SO3N4C17H28 |
AB3C4D17E28 |
-115.14 |
4.8 |
-8.86 |
-0.28 |
0 |
|
|
359871 |
127299915 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-116.02 |
3.1 |
-8.67 |
0.28 |
0 |
|
|
359872 |
127299916 |
3 |
ON2C6H10 |
AB2C6D10 |
-86.31 |
4.16 |
-8.97 |
0.33 |
0 |
|
|
359873 |
127299917 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-36.48 |
3.42 |
-8.73 |
-1.06 |
0 |
|
|
359874 |
127299918 |
1 |
O4N5C17H27 |
A4B5C17D27 |
-103.65 |
4.48 |
-9.22 |
-0.11 |
0 |
|
|
359875 |
127299919 |
1 |
O3N4C21H38 |
A3B4C21D38 |
-156.8 |
4.7 |
-8.68 |
0.66 |
0 |
|
|
359876 |
127299920 |
1 |
O2N6C17H30 |
A2B6C17D30 |
-50.99 |
7.28 |
-8.66 |
0.4 |
0 |
|
|
359877 |
127299921 |
1 |
O2N6C21H30 |
A2B6C21D30 |
-13.69 |
5.16 |
-8.73 |
-0.28 |
0 |
|
|
359878 |
127299922 |
1 |
O3N4C17H30 |
A3B4C17D30 |
-138.29 |
6.95 |
-8.55 |
0.76 |
0 |
|
|
359879 |
127299923 |
1 |
O3N5C20H37 |
A3B5C20D37 |
-143.2 |
4.2 |
-8.71 |
0.66 |
0 |
|
|
359880 |
127299924 |
1 |
O3N4C20H36 |
A3B4C20D36 |
-155.44 |
3.71 |
-8.79 |
0.96 |
0 |
|
|
359881 |
127299925 |
1 |
O3N4C18H32 |
A3B4C18D32 |
-148.03 |
3.66 |
-8.71 |
0.89 |
0 |
|
|
359882 |
127299926 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-71.95 |
2.05 |
-8.78 |
-0.54 |
0 |
|
|
359883 |
127299927 |
1 |
O3N4C18H32 |
A3B4C18D32 |
-135.4 |
3.54 |
-8.85 |
0.6 |
0 |
|
|
359884 |
127299928 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-84.32 |
4.87 |
-8.68 |
-0.99 |
0 |
|
|
359885 |
127299929 |
2 |
N2O2C9H16 |
A2B2C9D16 |
-176.76 |
1.88 |
-8.67 |
0.65 |
0 |
|
|
359886 |
127299930 |
1 |
O4N5C18H29 |
A4B5C18D29 |
-111.19 |
7.02 |
-8.92 |
0.2 |
0 |
|
|
359887 |
127299931 |
1 |
FN3O4C20H28 |
AB3C4D20E28 |
-191.94 |
3.66 |
-8.57 |
-0.4 |
0 |
|
|
359888 |
127299932 |
2 |
ON3C10H15 |
AB3C10D15 |
-20.55 |
2.05 |
-8.56 |
-0.41 |
0 |
|
|
359889 |
127299933 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-82.14 |
4.35 |
-8.54 |
-0.99 |
0 |
|
|
359890 |
127299934 |
1 |
O3N5C20H37 |
A3B5C20D37 |
-137.11 |
4.23 |
-8.68 |
0.77 |
0 |
|
|
359891 |
127299935 |
1 |
BrOSN5C13H18 |
ABCD5E13F18 |
48.78 |
2.59 |
-9.02 |
-0.86 |
0 |
|
|
359892 |
127299936 |
1 |
BrN6C15H21 |
AB6C15D21 |
77.68 |
7.57 |
-9.38 |
0.06 |
0 |
|
|
359893 |
127299937 |
1 |
BrON6C16H19 |
ABC6D16E19 |
66.73 |
3.79 |
-8.83 |
-0.87 |
0 |
|
|
359894 |
127299938 |
1 |
BrON6C16H23 |
ABC6D16E23 |
24.82 |
4.29 |
-8.54 |
-0.06 |
0 |
|
|
359895 |
127299939 |
1 |
BrON4C17H27 |
ABC4D17E27 |
-34.02 |
3.65 |
-9.4 |
0.03 |
0 |
|
|
359896 |
127299940 |
1 |
BrON4C17H27 |
ABC4D17E27 |
-30.66 |
2.97 |
-9.43 |
0.0 |
0 |
|
|
359897 |
127299941 |
1 |
BrN7C13H18 |
AB7C13D18 |
134.96 |
4.5 |
-9.54 |
-0.35 |
0 |
|
|
359898 |
127299942 |
1 |
BrON4C18H29 |
ABC4D18E29 |
-37.63 |
2.72 |
-9.14 |
0.02 |
0 |
|
|
359899 |
127299943 |
1 |
BrO2N5C14H20 |
AB2C5D14E20 |
-34.31 |
5.37 |
-9.57 |
-0.13 |
0 |
|
|
359900 |
127299944 |
1 |
BrON5C17H28 |
ABC5D17E28 |
-22.47 |
2.81 |
-8.81 |
0.01 |
0 |
|
|
359901 |
127299945 |
1 |
BrON5C17H18 |
ABC5D17E18 |
51.29 |
4.53 |
-9.24 |
-1.06 |
0 |
|
|
359902 |
127299946 |
1 |
BrON4C17H27 |
ABC4D17E27 |
-33.42 |
1.62 |
-9.25 |
-0.02 |
0 |
|
|
359903 |
127299947 |
1 |
BrON4C18H29 |
ABC4D18E29 |
-38.09 |
2.02 |
-9.16 |
0.0 |
0 |
|
|
359904 |
127299948 |
1 |
BrON4C18H29 |
ABC4D18E29 |
-39.09 |
3.49 |
-9.41 |
0.03 |
0 |
|
|
359905 |
127299949 |
1 |
BrON4C18H27 |
ABC4D18E27 |
-16.03 |
1.2 |
-9.2 |
-0.04 |
0 |
|
|
359906 |
127299950 |
1 |
BrON4C16H25 |
ABC4D16E25 |
-28.32 |
1.81 |
-9.24 |
-0.03 |
0 |
|
|
359907 |
127299951 |
1 |
NSO3C10H21 |
ABC3D10E21 |
-163.34 |
4.67 |
-10.01 |
0.54 |
0 |
|
|
359908 |
127299952 |
1 |
SN2O4C11H22 |
AB2C4D11E22 |
-172.66 |
4.93 |
-9.04 |
0.39 |
0 |
|
|
359909 |
127299953 |
1 |
N2S2O5C16H24 |
A2B2C5D16E24 |
-193.65 |
4.22 |
-9.27 |
-0.51 |
0 |
|
|
359910 |
127299954 |
1 |
NS2O5C12H23 |
AB2C5D12E23 |
-230.54 |
7.6 |
-9.81 |
-0.13 |
0 |
|
|
359911 |
127299955 |
1 |
S2N3O5C16H21 |
A2B3C5D16E21 |
-148.14 |
5.29 |
-9.45 |
-1.29 |
0 |
|
|
359912 |
127299956 |
1 |
NS2O5C11H21 |
AB2C5D11E21 |
-236.05 |
10.28 |
-10.23 |
0.18 |
0 |