List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
23871 |
606962 |
3 |
NH3C4 |
AB3C4 |
90.9 |
5.03 |
-9.27 |
-1.16 |
0 |
|
|
23872 |
606963 |
2 |
ON2H10C14 |
AB2C10D14 |
70.97 |
3.88 |
-8.79 |
-1.51 |
0 |
|
|
23873 |
606964 |
2 |
NC10H10 |
AB10C10 |
72.61 |
3.4 |
-8.09 |
-0.13 |
0 |
|
|
23874 |
606973 |
2 |
NO3C8H8 |
AB3C8D8 |
-110.13 |
3.58 |
-8.56 |
-1.48 |
0 |
|
|
23875 |
606977 |
1 |
NSO3C22H33 |
ABC3D22E33 |
-117.8 |
5.18 |
-9.62 |
-2.28 |
0 |
|
|
23876 |
606980 |
1 |
N2O5H8C9 |
A2B5C8D9 |
-22.8 |
4.99 |
-10.99 |
-2.33 |
0 |
|
|
23877 |
606981 |
2 |
OC9H10 |
AB9C10 |
-65.1 |
2.91 |
-9.4 |
-0.04 |
0 |
|
|
23878 |
606982 |
1 |
ON3H17C20 |
AB3C17D20 |
61.73 |
3.64 |
-8.78 |
-0.47 |
0 |
|
|
23879 |
606984 |
1 |
O4C13H18 |
A4B13C18 |
-154.2 |
5.69 |
-8.72 |
0.3 |
0 |
|
|
23880 |
606986 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-105.83 |
3.29 |
-9.99 |
-0.55 |
0 |
|
|
23881 |
606989 |
2 |
ON3C6H10 |
AB3C6D10 |
-34.47 |
1.86 |
-8.8 |
-0.17 |
0 |
|
|
23882 |
606990 |
1 |
N4O5C14H16 |
A4B5C14D16 |
-121.24 |
4.76 |
-8.66 |
-0.91 |
0 |
|
|
23883 |
606992 |
1 |
N2H3O3F15C22 |
A2B3C3D15E22 |
-663.36 |
3.56 |
-10.59 |
-1.92 |
0 |
|
|
23884 |
606993 |
1 |
ClNO3H16C21 |
ABC3D16E21 |
-49.55 |
2.6 |
-8.52 |
-0.86 |
0 |
|
|
23885 |
606996 |
1 |
N2O5F7C18H21 |
A2B5C7D18E21 |
-568.56 |
3.8 |
-10.53 |
-0.74 |
0 |
|
|
23886 |
607010 |
1 |
SCl2O2H12C17 |
AB2C2D12E17 |
-45.6 |
2.25 |
-8.73 |
-0.82 |
0 |
|
|
23887 |
607011 |
1 |
ClNS2O3H16C19 |
ABC2D3E16F19 |
-81.86 |
5.87 |
-8.42 |
-1.51 |
0 |
|
|
23888 |
607015 |
1 |
NOSCl3H8C15 |
ABCD3E8F15 |
2.91 |
7.56 |
-8.99 |
-1.53 |
0 |
|
|
23889 |
607016 |
1 |
ClSN2O2C17H17 |
ABC2D2E17F17 |
-36.2 |
2.88 |
-9.03 |
-1.28 |
0 |
|
|
23890 |
607020 |
1 |
ClSN2O4H11C16 |
ABC2D4E11F16 |
-25.31 |
2.99 |
-8.92 |
-1.54 |
0 |
|
|
23891 |
607021 |
1 |
ClNOSH12C13 |
ABCDE12F13 |
-12.63 |
4.95 |
-8.83 |
-0.97 |
0 |
|
|
23892 |
607023 |
1 |
ClSN2O3H9C15 |
ABC2D3E9F15 |
15.37 |
10.05 |
-9.24 |
-1.59 |
0 |
|
|
23893 |
607024 |
1 |
ClNSO2H12C17 |
ABCD2E12F17 |
-25.0 |
7.96 |
-9.09 |
-1.52 |
0 |
|
|
23894 |
607026 |
1 |
ClSN2O3H11C16 |
ABC2D3E11F16 |
4.13 |
11.05 |
-9.32 |
-1.72 |
0 |
|
|
23895 |
607031 |
1 |
ClNO4C13H14 |
ABC4D13E14 |
-165.9 |
6.73 |
-10.07 |
-1.13 |
0 |
|
|
23896 |
607033 |
1 |
ClNOSH12C16 |
ABCDE12F16 |
7.16 |
3.31 |
-8.82 |
-1.32 |
0 |
|
|
23897 |
607035 |
1 |
ClNOSH10C15 |
ABCDE10F15 |
19.15 |
4.58 |
-8.81 |
-1.38 |
0 |
|
|
23898 |
607038 |
1 |
ClINOSH9C15 |
ABCDEF9G15 |
34.94 |
6.27 |
-8.87 |
-1.52 |
0 |
|
|
23899 |
607039 |
1 |
PN2O7C15H27 |
AB2C7D15E27 |
-389.43 |
2.24 |
-9.74 |
-0.58 |
0 |
|
|
23900 |
607040 |
1 |
NSC14H23 |
ABC14D23 |
-18.37 |
1.88 |
-8.44 |
0.04 |
0 |
|
|
23901 |
607041 |
2 |
NOH10C11 |
ABC10D11 |
23.35 |
5.38 |
-8.78 |
-0.47 |
0 |
|
|
23902 |
607045 |
2 |
OF2H3C4 |
AB2C3D4 |
-222.35 |
0.02 |
-8.94 |
-0.82 |
0 |
|
|
23903 |
607046 |
2 |
C8H9 |
A8B9 |
14.16 |
0.61 |
-8.77 |
0.49 |
0 |
|
|
23904 |
607053 |
2 |
NO3C9H9 |
AB3C9D9 |
-129.49 |
3.5 |
-8.57 |
-0.85 |
0 |
|
|
23905 |
607054 |
1 |
N2O5C16H18 |
A2B5C16D18 |
-103.42 |
5.5 |
-8.61 |
-0.56 |
0 |
|
|
23906 |
607055 |
1 |
ClNO4C18H20 |
ABC4D18E20 |
-122.68 |
2.4 |
-8.94 |
-0.26 |
0 |
|
|
23907 |
607056 |
1 |
NOF5H10C12 |
ABC5D10E12 |
-252.26 |
4.24 |
-10.19 |
-1.51 |
0 |
|
|
23908 |
607058 |
1 |
NO6H7C8 |
AB6C7D8 |
-148.26 |
3.47 |
-9.74 |
-2.25 |
0 |
|
|
23909 |
607060 |
1 |
O2F5H7C10 |
A2B5C7D10 |
-288.77 |
2.15 |
-10.78 |
-1.72 |
0 |
|
|
23910 |
607065 |
1 |
ON2H12C14 |
AB2C12D14 |
40.15 |
4.59 |
-9.92 |
-1.07 |
0 |
|
|
23911 |
607068 |
1 |
BN2C14H17 |
AB2C14D17 |
-8.89 |
0.7 |
-8.23 |
0.13 |
0 |
|
|
23912 |
607070 |
2 |
NOH6C7 |
ABC6D7 |
28.82 |
2.08 |
-8.35 |
-1.39 |
0 |
|
|
23913 |
607074 |
1 |
NO2H13C14 |
AB2C13D14 |
-39.11 |
1.0 |
-8.45 |
-0.54 |
0 |
|
|
23914 |
607080 |
2 |
O2C7H9 |
A2B7C9 |
-173.68 |
4.12 |
-8.92 |
0.15 |
0 |
|
|
23915 |
607087 |
1 |
NOF5H10C11 |
ABC5D10E11 |
-257.07 |
4.08 |
-10.2 |
-1.5 |
0 |
|
|
23916 |
607096 |
1 |
NOF5C17H20 |
ABC5D17E20 |
-270.98 |
4.62 |
-9.72 |
-1.41 |
0 |
|
|
23917 |
607109 |
1 |
NOF8H15C19 |
ABC8D15E19 |
-392.31 |
6.61 |
-9.87 |
-1.5 |
0 |
|
|
23918 |
607110 |
1 |
NO5H11C16 |
AB5C11D16 |
-122.77 |
9.81 |
-9.73 |
-2.01 |
0 |
|
|
23919 |
607111 |
1 |
ClON2H13C15 |
ABC2D13E15 |
29.24 |
4.52 |
-9.26 |
-0.64 |
0 |
|
|
23920 |
607112 |
1 |
BrN2H11C13 |
AB2C11D13 |
86.7 |
0.84 |
-8.41 |
-0.65 |
0 |