List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
210895 |
80868837 |
1 |
ON6C12H16 |
AB6C12D16 |
23.66 |
7.71 |
-9.24 |
-0.9 |
0 |
|
|
210896 |
80868838 |
1 |
ON6C8H8 |
AB6C8D8 |
48.07 |
6.12 |
-9.68 |
-1.2 |
0 |
|
|
210897 |
80868839 |
1 |
ON6C9H10 |
AB6C9D10 |
48.07 |
6.93 |
-9.46 |
-1.12 |
0 |
|
|
210898 |
80868840 |
1 |
ON6C12H16 |
AB6C12D16 |
21.77 |
7.1 |
-9.38 |
-0.9 |
0 |
|
|
210899 |
80868841 |
1 |
ON6C11H14 |
AB6C11D14 |
40.95 |
9.03 |
-9.16 |
-1.25 |
0 |
|
|
210900 |
80869087 |
1 |
BrClON3H9C11 |
ABCD3E9F11 |
28.03 |
3.98 |
-9.01 |
-0.55 |
0 |
|
|
210901 |
80869088 |
1 |
BrON2C13H13 |
ABC2D13E13 |
18.51 |
3.83 |
-8.7 |
-0.38 |
0 |
|
|
210902 |
80869385 |
1 |
ClON3C12H12 |
ABC3D12E12 |
9.19 |
4.53 |
-9.09 |
-0.61 |
0 |
|
|
210903 |
80869788 |
1 |
ON5C13H17 |
AB5C13D17 |
32.99 |
2.68 |
-9.13 |
0.1 |
0 |
|
|
210904 |
80869789 |
1 |
ON3C12H13 |
AB3C12D13 |
21.95 |
2.41 |
-9.05 |
-0.08 |
0 |
|
|
210905 |
80869855 |
1 |
ON3H13C15 |
AB3C13D15 |
33.59 |
1.4 |
-8.89 |
-0.55 |
0 |
|
|
210906 |
80869856 |
1 |
ClON3C13H14 |
ABC3D13E14 |
10.11 |
1.08 |
-8.9 |
-0.44 |
0 |
|
|
210907 |
80870055 |
1 |
BrON3H10C11 |
ABC3D10E11 |
25.74 |
3.66 |
-9.15 |
-0.45 |
0 |
|
|
210908 |
80870194 |
1 |
O3N4C13H16 |
A3B4C13D16 |
-52.84 |
3.88 |
-8.73 |
-0.15 |
0 |
|
|
210909 |
80870273 |
1 |
BrON2H13C16 |
ABC2D13E16 |
38.62 |
3.21 |
-8.72 |
-0.83 |
0 |
|
|
210910 |
80870295 |
1 |
FON3C12H12 |
ABC3D12E12 |
-28.12 |
2.55 |
-9.09 |
-0.24 |
0 |
|
|
210911 |
80870611 |
1 |
FON4C10H15 |
ABC4D10E15 |
-49.01 |
3.3 |
-9.16 |
-0.3 |
0 |
|
|
210912 |
80870628 |
2 |
ON3C6H11 |
AB3C6D11 |
-39.91 |
1.82 |
-8.9 |
0.07 |
0 |
|
|
210913 |
80870641 |
1 |
O3N4C13H14 |
A3B4C13D14 |
9.21 |
5.85 |
-9.19 |
-1.3 |
0 |
|
|
210914 |
80870642 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-95.95 |
0.71 |
-9.48 |
0.04 |
0 |
|
|
210915 |
80870643 |
1 |
O3N4C9H14 |
A3B4C9D14 |
-84.46 |
2.11 |
-9.89 |
-0.14 |
0 |
|
|
210916 |
80871033 |
1 |
O3N4C13H16 |
A3B4C13D16 |
-52.62 |
2.31 |
-9.51 |
-0.33 |
0 |
|
|
210917 |
80871141 |
2 |
ON2C6H7 |
AB2C6D7 |
-23.4 |
2.67 |
-9.02 |
-0.06 |
0 |
|
|
210918 |
80871222 |
1 |
OSN4C12H20 |
ABC4D12E20 |
-13.19 |
3.18 |
-8.63 |
-0.04 |
0 |
|
|
210919 |
80871223 |
1 |
O2N5C12H21 |
A2B5C12D21 |
-45.14 |
3.09 |
-9.07 |
0.14 |
0 |
|
|
210920 |
80871224 |
1 |
ON4C13H22 |
AB4C13D22 |
-27.34 |
3.33 |
-9.04 |
-0.02 |
0 |
|
|
210921 |
80871225 |
1 |
ON6C13H24 |
AB6C13D24 |
-4.13 |
1.91 |
-8.75 |
0.44 |
0 |
|
|
210922 |
80871226 |
1 |
ON4C9H16 |
AB4C9D16 |
-12.17 |
3.44 |
-8.85 |
0.01 |
0 |
|
|
210923 |
80871227 |
1 |
ON5C9H17 |
AB5C9D17 |
-16.39 |
2.5 |
-8.82 |
0.44 |
0 |
|
|
210924 |
80871282 |
1 |
ON5C15H27 |
AB5C15D27 |
-33.6 |
2.74 |
-9.02 |
0.37 |
0 |
|
|
210925 |
80871283 |
1 |
ON4C12H16 |
AB4C12D16 |
12.24 |
3.56 |
-8.63 |
-0.45 |
0 |
|
|
210926 |
80871388 |
1 |
ClN2O3C15H15 |
AB2C3D15E15 |
-19.98 |
7.3 |
-8.93 |
-0.78 |
0 |
|
|
210927 |
80871389 |
1 |
ClON5C14H16 |
ABC5D14E16 |
17.62 |
5.33 |
-9.19 |
-0.26 |
0 |
|
|
210928 |
80871390 |
1 |
ClON5C14H18 |
ABC5D14E18 |
8.51 |
5.36 |
-9.18 |
-0.13 |
0 |
|
|
210929 |
80871876 |
1 |
ClON6H11C13 |
ABC6D11E13 |
84.21 |
3.96 |
-9.62 |
-1.04 |
0 |
|
|
210930 |
80871944 |
1 |
O3N4C13H14 |
A3B4C13D14 |
9.39 |
3.64 |
-9.38 |
-1.3 |
0 |
|
|
210931 |
80872181 |
1 |
ON5C13H21 |
AB5C13D21 |
-3.03 |
2.87 |
-8.96 |
0.38 |
0 |
|
|
210932 |
80873103 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
44.9 |
5.84 |
-9.0 |
-1.44 |
0 |
|
|
210933 |
80873685 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-17.87 |
2.46 |
-9.49 |
-0.1 |
0 |
|
|
210934 |
80874050 |
1 |
FON3C16H20 |
ABC3D16E20 |
-39.78 |
3.61 |
-9.04 |
-0.33 |
0 |
|
|
210935 |
80874051 |
1 |
ON3C17H23 |
AB3C17D23 |
-12.18 |
2.67 |
-8.99 |
0.12 |
0 |
|
|
210936 |
80874052 |
1 |
ON3C17H23 |
AB3C17D23 |
-7.76 |
3.1 |
-8.96 |
-0.13 |
0 |
|
|
210937 |
80874196 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-33.18 |
6.62 |
-8.78 |
-0.3 |
0 |
|
|
210938 |
80874197 |
1 |
O2N5C14H17 |
A2B5C14D17 |
-33.46 |
6.05 |
-8.72 |
0.01 |
0 |
|
|
210939 |
80874253 |
1 |
ClON4C15H19 |
ABC4D15E19 |
9.72 |
2.23 |
-9.5 |
-0.53 |
0 |
|
|
210940 |
80874389 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-32.31 |
3.63 |
-8.76 |
-0.28 |
0 |
|
|
210941 |
80874476 |
1 |
OCl2N4H8C10 |
AB2C4D8E10 |
8.67 |
4.05 |
-9.29 |
-0.53 |
0 |
|
|
210942 |
80874477 |
1 |
OCl2N2H12C13 |
AB2C2D12E13 |
0.78 |
5.08 |
-8.78 |
-0.59 |
0 |
|
|
210943 |
80874478 |
1 |
OCl2N3C13H13 |
AB2C3D13E13 |
-4.25 |
4.36 |
-9.1 |
-0.53 |
0 |
|
|
210944 |
80875859 |
1 |
ClOSN3C14H16 |
ABCD3E14F16 |
-4.11 |
2.3 |
-8.74 |
-0.24 |
0 |