List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126836 |
50980788 |
1 |
ON4C17H28 |
AB4C17D28 |
-15.73 |
5.47 |
-8.45 |
0.42 |
0 |
|
|
126837 |
50980789 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-43.27 |
4.42 |
-8.52 |
-0.65 |
0 |
|
|
126838 |
50980872 |
1 |
ON5C22H23 |
AB5C22D23 |
53.14 |
2.1 |
-8.74 |
-0.81 |
0 |
|
|
126839 |
50980873 |
1 |
SO2N5C13H13 |
AB2C5D13E13 |
76.41 |
3.31 |
-9.28 |
-1.65 |
0 |
|
|
126840 |
50980978 |
1 |
O2N7C12H13 |
A2B7C12D13 |
57.2 |
4.58 |
-8.94 |
-0.56 |
0 |
|
|
126841 |
50981052 |
1 |
ON4C19H24 |
AB4C19D24 |
23.85 |
1.94 |
-9.11 |
-0.18 |
0 |
|
|
126842 |
50981095 |
1 |
ON4C19H28 |
AB4C19D28 |
-24.21 |
2.83 |
-8.72 |
0.12 |
0 |
|
|
126843 |
50981146 |
1 |
N5C17H23 |
A5B17C23 |
50.77 |
6.97 |
-9.05 |
-0.67 |
0 |
|
|
126844 |
50981162 |
2 |
ON2C7H8 |
AB2C7D8 |
-22.0 |
7.16 |
-9.06 |
0.02 |
0 |
|
|
126845 |
50981202 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-4.46 |
2.36 |
-8.93 |
-0.8 |
0 |
|
|
126846 |
50981211 |
1 |
ON3C14H17 |
AB3C14D17 |
35.95 |
4.35 |
-8.97 |
0.06 |
0 |
|
|
126847 |
50981212 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-37.76 |
4.92 |
-8.45 |
-0.56 |
0 |
|
|
126848 |
50981625 |
1 |
FSN3O4C16H16 |
ABC3D4E16F16 |
-159.96 |
5.14 |
-8.47 |
-0.55 |
0 |
|
|
126849 |
50981626 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-33.4 |
6.35 |
-8.79 |
-0.29 |
0 |
|
|
126850 |
50981627 |
1 |
O2N4H16C19 |
A2B4C16D19 |
54.14 |
4.63 |
-9.18 |
-0.77 |
0 |
|
|
126851 |
50981628 |
1 |
ON4C18H20 |
AB4C18D20 |
77.55 |
4.8 |
-9.14 |
-0.49 |
0 |
|
|
126852 |
50981629 |
1 |
SO2N4C17H18 |
AB2C4D17E18 |
20.85 |
6.04 |
-9.26 |
-1.04 |
0 |
|
|
126853 |
50981630 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-133.39 |
8.35 |
-9.22 |
1.14 |
0 |
|
|
126854 |
50981631 |
1 |
O3N5C15H15 |
A3B5C15D15 |
-20.46 |
5.14 |
-8.88 |
-0.52 |
0 |
|
|
126855 |
50981718 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-107.42 |
2.34 |
-8.64 |
0.11 |
0 |
|
|
126856 |
50981729 |
1 |
OSN6H16C17 |
ABC6D16E17 |
83.23 |
4.06 |
-8.99 |
-1.32 |
0 |
|
|
126857 |
50981889 |
2 |
ON2C9H10 |
AB2C9D10 |
2.14 |
6.43 |
-9.03 |
-0.65 |
0 |
|
|
126858 |
50982101 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-174.46 |
6.53 |
-8.94 |
-0.12 |
0 |
|
|
126859 |
50982110 |
1 |
FSN2O3C19H23 |
ABC2D3E19F23 |
-130.57 |
5.71 |
-9.33 |
-0.53 |
0 |
|
|
126860 |
50982271 |
1 |
N5C23H25 |
A5B23C25 |
97.02 |
3.65 |
-8.4 |
-0.16 |
0 |
|
|
126861 |
50982300 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-158.47 |
6.39 |
-8.38 |
0.17 |
0 |
|
|
126862 |
50982354 |
1 |
ON3C17H17 |
AB3C17D17 |
50.03 |
6.14 |
-9.11 |
-1.02 |
0 |
|
|
126863 |
50982604 |
1 |
ON4H22C24 |
AB4C22D24 |
61.69 |
5.16 |
-8.54 |
-1.07 |
0 |
|
|
126864 |
50982656 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-117.68 |
2.61 |
-8.33 |
0.06 |
0 |
|
|
126865 |
50982753 |
1 |
SN3O3C15H19 |
AB3C3D15E19 |
-75.07 |
3.25 |
-8.99 |
-0.68 |
0 |
|
|
126866 |
50982754 |
1 |
N4O5C16H22 |
A4B5C16D22 |
-185.25 |
6.23 |
-9.1 |
-0.09 |
0 |
|
|
126867 |
50982755 |
1 |
ON6C19H22 |
AB6C19D22 |
73.81 |
5.71 |
-8.31 |
-0.47 |
0 |
|
|
126868 |
50982756 |
1 |
N4O4H18C19 |
A4B4C18D19 |
15.75 |
3.55 |
-8.86 |
-0.73 |
0 |
|
|
126869 |
50982757 |
1 |
ON4C18H22 |
AB4C18D22 |
29.25 |
7.36 |
-8.88 |
-0.84 |
0 |
|
|
126870 |
50982839 |
1 |
O2N5H19C20 |
A2B5C19D20 |
79.94 |
2.24 |
-9.07 |
-1.72 |
0 |
|
|
126871 |
50982840 |
1 |
OSN4C17H20 |
ABC4D17E20 |
25.6 |
4.49 |
-8.64 |
-0.74 |
0 |
|
|
126872 |
50982872 |
1 |
ON7C12H19 |
AB7C12D19 |
26.35 |
5.65 |
-8.59 |
-0.62 |
0 |
|
|
126873 |
50982920 |
1 |
ON8C18H20 |
AB8C18D20 |
107.96 |
7.68 |
-8.9 |
-0.75 |
0 |
|
|
126874 |
50982921 |
1 |
N5C18H21 |
A5B18C21 |
135.07 |
2.81 |
-8.92 |
-0.37 |
0 |
|
|
126875 |
50982934 |
1 |
FON4H15C17 |
ABC4D15E17 |
51.16 |
6.0 |
-8.97 |
-0.84 |
0 |
|
|
126876 |
50982935 |
1 |
SO2N5C19H25 |
AB2C5D19E25 |
-11.98 |
5.48 |
-8.72 |
-0.42 |
0 |
|
|
126877 |
50982936 |
1 |
O2N6C13H16 |
A2B6C13D16 |
25.62 |
3.08 |
-9.36 |
-0.45 |
0 |
|
|
126878 |
50982937 |
2 |
NOC11H14 |
ABC11D14 |
-48.31 |
4.11 |
-8.04 |
0.5 |
0 |
|
|
126879 |
50982938 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-97.56 |
3.0 |
-8.16 |
-0.41 |
0 |
|
|
126880 |
50982939 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-13.11 |
6.4 |
-8.86 |
-0.43 |
0 |
|
|
126881 |
50982940 |
1 |
N2O3C18H20 |
A2B3C18D20 |
-79.49 |
4.95 |
-9.39 |
-0.92 |
0 |
|
|
126882 |
50982963 |
1 |
N4C19H24 |
A4B19C24 |
67.73 |
3.82 |
-9.36 |
-0.77 |
0 |
|
|
126883 |
50983148 |
1 |
ON5C16H19 |
AB5C16D19 |
52.94 |
7.23 |
-8.5 |
-0.16 |
0 |
|
|
126884 |
50983149 |
1 |
O2N4H14C15 |
A2B4C14D15 |
11.15 |
3.84 |
-8.28 |
-0.79 |
0 |
|
|
126885 |
50983150 |
1 |
SO2N6C16H20 |
AB2C6D16E20 |
8.86 |
8.34 |
-9.19 |
-1.95 |
0 |
|
|
126886 |
50983151 |
1 |
N4O5C18H18 |
A4B5C18D18 |
-140.72 |
9.79 |
-9.25 |
-0.89 |
0 |
|
|
126887 |
50983152 |
1 |
ON7C12H17 |
AB7C12D17 |
41.48 |
4.5 |
-9.63 |
-0.93 |
0 |
|
|
126888 |
50983153 |
1 |
N5C20H23 |
A5B20C23 |
86.89 |
3.52 |
-8.63 |
-0.74 |
0 |
|
|
126889 |
50983154 |
1 |
ON6C20H28 |
AB6C20D28 |
21.47 |
5.77 |
-9.11 |
-0.43 |
0 |
|
|
126890 |
50983155 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-27.89 |
6.2 |
-8.36 |
-0.23 |
0 |
|
|
126891 |
50983183 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-7.07 |
5.36 |
-9.1 |
-0.68 |
0 |
|
|
126892 |
50983333 |
1 |
SN3C12H19 |
AB3C12D19 |
23.71 |
3.4 |
-8.64 |
-0.01 |
0 |
|
|
126893 |
50983334 |
1 |
N5C23H25 |
A5B23C25 |
104.37 |
4.99 |
-8.83 |
-0.71 |
0 |
|
|
126894 |
50983335 |
1 |
ON6C15H24 |
AB6C15D24 |
-8.42 |
4.12 |
-8.88 |
0.25 |
0 |
|
|
126895 |
50983336 |
2 |
NOC8H11 |
ABC8D11 |
-53.95 |
4.27 |
-8.72 |
0.3 |
0 |
|
|
126896 |
50983337 |
1 |
SN3H15C16 |
AB3C15D16 |
92.17 |
3.6 |
-9.18 |
-0.76 |
0 |
|
|
126897 |
50983338 |
1 |
FNO3C20H22 |
ABC3D20E22 |
-138.79 |
1.97 |
-8.88 |
-0.4 |
0 |
|
|
126898 |
50983360 |
1 |
ON5C17H19 |
AB5C17D19 |
56.36 |
3.29 |
-8.38 |
-0.63 |
0 |
|
|
126899 |
50983379 |
1 |
FN2O5C19H23 |
AB2C5D19E23 |
-247.45 |
2.13 |
-9.18 |
-0.43 |
0 |
|
|
126900 |
50983504 |
1 |
OCl2N3C15H15 |
AB2C3D15E15 |
-12.66 |
7.84 |
-9.14 |
-0.83 |
0 |
|
|
126901 |
50983506 |
1 |
ON4H16C20 |
AB4C16D20 |
90.81 |
7.89 |
-8.71 |
-0.75 |
0 |
|
|
126902 |
50983540 |
1 |
SO2N5C16H23 |
AB2C5D16E23 |
-17.01 |
5.67 |
-8.86 |
-0.15 |
0 |
|
|
126903 |
50983765 |
1 |
N4O5C17H20 |
A4B5C17D20 |
-167.84 |
5.62 |
-9.64 |
-0.54 |
0 |
|
|
126904 |
50983777 |
1 |
O2N3C24H27 |
A2B3C24D27 |
-0.93 |
4.04 |
-8.52 |
-0.51 |
0 |
|
|
126905 |
50983809 |
1 |
ON3C21H23 |
AB3C21D23 |
37.16 |
5.84 |
-8.69 |
-0.3 |
0 |
|
|
126906 |
50983883 |
1 |
SN3O3C19H23 |
AB3C3D19E23 |
-74.01 |
5.5 |
-8.14 |
-0.21 |
0 |
|
|
126907 |
50983884 |
1 |
OSN2C15H26 |
ABC2D15E26 |
-35.1 |
2.92 |
-8.59 |
0.2 |
0 |
|
|
126908 |
50983885 |
1 |
ON5H19C21 |
AB5C19D21 |
102.77 |
5.75 |
-9.22 |
-0.97 |
0 |
|
|
126909 |
50983886 |
1 |
FON3H12C16 |
ABC3D12E16 |
0.28 |
5.81 |
-8.76 |
-1.21 |
0 |
|
|
126910 |
50983901 |
1 |
O2N5C18H19 |
A2B5C18D19 |
19.95 |
4.4 |
-9.21 |
-0.98 |
0 |
|
|
126911 |
50983902 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-31.04 |
1.96 |
-8.95 |
-0.54 |
0 |
|
|
126912 |
50984223 |
1 |
O2N5C17H21 |
A2B5C17D21 |
-23.04 |
8.15 |
-9.38 |
-0.17 |
0 |
|
|
126913 |
50984236 |
1 |
SN3O3C14H19 |
AB3C3D14E19 |
-97.0 |
2.2 |
-9.24 |
-0.55 |
0 |
|
|
126914 |
50984266 |
1 |
SN3C18H21 |
AB3C18D21 |
60.93 |
3.44 |
-8.84 |
-0.52 |
0 |
|
|
126915 |
50984333 |
1 |
FO2N5C19H20 |
AB2C5D19E20 |
-45.59 |
4.71 |
-9.06 |
-0.51 |
0 |
|
|
126916 |
50984443 |
1 |
FN3O4C19H22 |
AB3C4D19E22 |
-150.47 |
4.63 |
-9.59 |
-0.61 |
0 |
|
|
126917 |
50984478 |
1 |
O2N5C19H21 |
A2B5C19D21 |
-12.16 |
2.33 |
-9.12 |
-0.8 |
0 |
|
|
126918 |
50984479 |
1 |
NOF2C18H25 |
ABC2D18E25 |
-157.04 |
2.67 |
-9.2 |
-0.49 |
0 |
|
|
126919 |
50984480 |
1 |
OSN7C17H23 |
ABC7D17E23 |
62.37 |
6.05 |
-8.96 |
-0.72 |
0 |
|
|
126920 |
50984530 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-50.01 |
3.77 |
-8.94 |
0.01 |
0 |
|
|
126921 |
50984531 |
1 |
ON3C14H17 |
AB3C14D17 |
11.66 |
5.03 |
-8.62 |
0.48 |
0 |
|
|
126922 |
50984532 |
1 |
O2N6C15H22 |
A2B6C15D22 |
2.21 |
1.1 |
-8.64 |
-0.52 |
0 |
|
|
126923 |
50984533 |
1 |
ClO2N3C17H24 |
AB2C3D17E24 |
-90.23 |
5.24 |
-8.54 |
-0.43 |
0 |
|
|
126924 |
50984534 |
1 |
ClON3H18C19 |
ABC3D18E19 |
27.14 |
3.33 |
-9.66 |
-1.16 |
0 |
|
|
126925 |
50984535 |
2 |
ON2C11H13 |
AB2C11D13 |
-12.59 |
8.23 |
-8.79 |
-0.56 |
0 |
|
|
126926 |
50984608 |
1 |
O3N6C16H20 |
A3B6C16D20 |
-43.56 |
7.53 |
-9.03 |
-0.16 |
0 |
|
|
126927 |
50984609 |
1 |
N3O3C16H23 |
A3B3C16D23 |
-76.25 |
6.8 |
-8.66 |
0.36 |
0 |
|
|
126928 |
50984624 |
1 |
ClO2N5C19H22 |
AB2C5D19E22 |
-49.28 |
6.7 |
-9.34 |
-0.76 |
0 |
|
|
126929 |
50984661 |
1 |
O2N3C24H27 |
A2B3C24D27 |
-25.58 |
5.09 |
-8.86 |
-0.24 |
0 |
|
|
126930 |
50984662 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-6.48 |
3.94 |
-9.26 |
-0.79 |
0 |
|
|
126931 |
50984663 |
1 |
ON4C16H16 |
AB4C16D16 |
67.31 |
8.18 |
-8.91 |
-1.37 |
0 |
|
|
126932 |
50984664 |
2 |
ON2C10H11 |
AB2C10D11 |
-2.89 |
3.51 |
-9.41 |
0.08 |
0 |
|
|
126933 |
50984665 |
1 |
ON5H13C15 |
AB5C13D15 |
57.13 |
1.58 |
-9.19 |
-0.88 |
0 |
|
|
126934 |
50984666 |
1 |
O2N5C16H21 |
A2B5C16D21 |
3.82 |
6.0 |
-8.81 |
-0.41 |
0 |
|
|
126935 |
50984667 |
1 |
N3O4C20H25 |
A3B4C20D25 |
-153.38 |
2.99 |
-8.88 |
0.18 |
0 |