List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
339854 |
127261863 |
1 |
O2N6C19H26 |
A2B6C19D26 |
-39.78 |
4.15 |
-8.83 |
-0.54 |
0 |
|
|
339855 |
127261864 |
1 |
O4N7C17H27 |
A4B7C17D27 |
-69.95 |
7.14 |
-9.17 |
-1.23 |
0 |
|
|
339856 |
127261865 |
1 |
O3N7C23H33 |
A3B7C23D33 |
-93.56 |
7.02 |
-9.03 |
-0.69 |
0 |
|
|
339857 |
127261866 |
1 |
O5N7C23H29 |
A5B7C23D29 |
-80.5 |
7.52 |
-9.16 |
-1.4 |
0 |
|
|
339858 |
127261867 |
1 |
O5N7C16H23 |
A5B7C16D23 |
-103.05 |
8.11 |
-9.14 |
-1.33 |
0 |
|
|
339859 |
127261868 |
1 |
O2N9C22H33 |
A2B9C22D33 |
-29.61 |
4.08 |
-9.38 |
-1.06 |
0 |
|
|
339860 |
127261869 |
1 |
NO4C28H55 |
AB4C28D55 |
-292.12 |
2.24 |
-10.07 |
0.6 |
0 |
|
|
339861 |
127261870 |
1 |
N2O7C12H12 |
A2B7C12D12 |
-186.54 |
3.59 |
-9.79 |
-2.23 |
0 |
|
|
339862 |
127261871 |
1 |
NO5C11H11 |
AB5C11D11 |
-170.68 |
3.85 |
-9.23 |
-1.49 |
0 |
|
|
339863 |
127261872 |
1 |
NSO4C11H19 |
ABC4D11E19 |
-188.38 |
5.39 |
-8.83 |
-0.24 |
0 |
|
|
339864 |
127261873 |
1 |
NSO3C10H11 |
ABC3D10E11 |
-85.86 |
4.87 |
-8.85 |
-1.15 |
0 |
|
|
339865 |
127261874 |
1 |
S2O3N4C6H10 |
A2B3C4D6E10 |
-83.21 |
3.19 |
-9.35 |
-1.38 |
0 |
|
|
339866 |
127261875 |
1 |
NSO4C13H21 |
ABC4D13E21 |
-180.84 |
7.72 |
-9.15 |
-0.33 |
0 |
|
|
339867 |
127261876 |
1 |
N2S2O5C9H16 |
A2B2C5D9E16 |
-218.94 |
7.06 |
-9.52 |
-0.57 |
0 |
|
|
339868 |
127261877 |
1 |
NSO4C14H19 |
ABC4D14E19 |
-175.98 |
8.53 |
-9.03 |
-0.26 |
0 |
|
|
339869 |
127261878 |
1 |
NSO4C7H13 |
ABC4D7E13 |
-183.6 |
6.27 |
-9.5 |
-0.29 |
0 |
|
|
339870 |
127261879 |
1 |
NSO4C8H13 |
ABC4D8E13 |
-179.38 |
8.46 |
-9.38 |
-0.16 |
0 |
|
|
339871 |
127261880 |
1 |
NSO3F5C7H8 |
ABC3D5E7F8 |
-367.2 |
6.45 |
-9.34 |
-0.77 |
0 |
|
|
339872 |
127261881 |
1 |
NSO6C9H19 |
ABC6D9E19 |
-279.37 |
2.95 |
-9.45 |
-0.04 |
0 |
|
|
339873 |
127261882 |
1 |
SO4N5C19H27 |
AB4C5D19E27 |
-143.06 |
2.82 |
-8.48 |
-0.36 |
0 |
|
|
339874 |
127261883 |
1 |
IN2S2O4C6H11 |
AB2C2D4E6F11 |
-155.99 |
9.0 |
-9.26 |
-2.98 |
0 |
|
|
339875 |
127261884 |
2 |
N2S2O4C9H11 |
A2B2C4D9E11 |
-291.32 |
11.06 |
-9.16 |
-1.37 |
0 |
|
|
339876 |
127261885 |
2 |
ClNSO5H13C14 |
ABCD5E13F14 |
-394.99 |
9.76 |
-9.31 |
-1.75 |
0 |
|
|
339877 |
127261886 |
1 |
NO6C11H19 |
AB6C11D19 |
-286.77 |
4.88 |
-10.76 |
-0.26 |
0 |
|
|
339878 |
127261887 |
1 |
NO6C8H15 |
AB6C8D15 |
-279.3 |
5.6 |
-10.52 |
0.09 |
0 |
|
|
339879 |
127261888 |
1 |
N2O7C9H14 |
A2B7C9D14 |
-317.88 |
7.26 |
-10.58 |
-0.41 |
0 |
|
|
339880 |
127261889 |
3 |
NO2C3H5 |
AB2C3D5 |
-211.04 |
6.8 |
-10.3 |
-0.84 |
0 |
|
|
339881 |
127261890 |
2 |
NO2C8H8 |
AB2C8D8 |
-130.16 |
5.44 |
-8.71 |
-1.06 |
0 |
|
|
339882 |
127261891 |
1 |
SeN3O7C12H21 |
AB3C7D12E21 |
-303.29 |
6.7 |
-9.4 |
-0.85 |
0 |
|
|
339883 |
127261892 |
1 |
SO3N6C12H20 |
AB3C6D12E20 |
-105.17 |
8.18 |
-9.08 |
-0.1 |
0 |
|
|
339884 |
127261893 |
1 |
O3N6C11H18 |
A3B6C11D18 |
-104.67 |
9.42 |
-9.0 |
0.12 |
0 |
|
|
339885 |
127261894 |
1 |
N4O5C19H26 |
A4B5C19D26 |
-139.22 |
2.74 |
-9.75 |
-1.78 |
0 |
|
|
339886 |
127261895 |
1 |
N3O4C14H23 |
A3B4C14D23 |
-198.71 |
5.95 |
-9.76 |
-0.09 |
0 |
|
|
339887 |
127261896 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-64.92 |
2.92 |
-9.41 |
-0.19 |
0 |
|
|
339888 |
127261897 |
1 |
O2N3C9H19 |
A2B3C9D19 |
-112.68 |
1.66 |
-9.75 |
0.41 |
0 |
|
|
339889 |
127261898 |
1 |
O3N5C24H37 |
A3B5C24D37 |
-123.54 |
3.98 |
-7.79 |
-0.19 |
0 |
|
|
339890 |
127261899 |
1 |
O2N3C17H35 |
A2B3C17D35 |
-148.74 |
5.57 |
-9.44 |
0.6 |
0 |
|
|
339891 |
127261900 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-108.92 |
7.51 |
-9.95 |
-1.43 |
0 |
|
|
339892 |
127261901 |
1 |
N3O4C15H29 |
A3B4C15D29 |
-229.98 |
2.36 |
-9.41 |
0.43 |
0 |
|
|
339893 |
127261902 |
1 |
N3O5C17H25 |
A3B5C17D25 |
-184.31 |
3.1 |
-9.69 |
-0.47 |
0 |
|
|
339894 |
127261903 |
1 |
N3O5C16H23 |
A3B5C16D23 |
-179.96 |
3.55 |
-9.7 |
-0.61 |
0 |
|
|
339895 |
127261904 |
1 |
N3O4C22H27 |
A3B4C22D27 |
-127.86 |
2.72 |
-9.4 |
-0.94 |
0 |
|
|
339896 |
127261905 |
1 |
N3O3C15H29 |
A3B3C15D29 |
-182.47 |
3.33 |
-9.41 |
0.66 |
0 |
|
|
339897 |
127261906 |
1 |
O2N3C18H29 |
A2B3C18D29 |
-98.38 |
5.15 |
-9.3 |
-0.07 |
0 |
|
|
339898 |
127261907 |
1 |
N2O3C13H26 |
A2B3C13D26 |
-175.75 |
4.46 |
-9.67 |
0.62 |
0 |
|
|
339899 |
127261908 |
1 |
NO3C15H27 |
AB3C15D27 |
-170.27 |
4.68 |
-10.04 |
0.37 |
0 |
|
|
339900 |
127261909 |
1 |
NSO3C17H25 |
ABC3D17E25 |
-145.14 |
7.07 |
-9.1 |
0.01 |
0 |
|
|
339901 |
127261910 |
1 |
NSO3C17H25 |
ABC3D17E25 |
-145.52 |
5.94 |
-9.01 |
0.03 |
0 |
|
|
339902 |
127261911 |
2 |
ON2C13H16 |
AB2C13D16 |
-40.36 |
7.03 |
-8.79 |
-0.44 |
0 |
|
|
339903 |
127261912 |
2 |
ON2C13H16 |
AB2C13D16 |
-36.98 |
3.39 |
-8.89 |
-0.53 |
0 |
|
|
339904 |
127261913 |
1 |
O2N9C17H33 |
A2B9C17D33 |
-58.56 |
8.82 |
-9.1 |
0.1 |
0 |
|
|
339905 |
127261914 |
2 |
ON2C11H15 |
AB2C11D15 |
-53.95 |
2.85 |
-9.28 |
0.23 |
0 |
|
|
339906 |
127261915 |
1 |
O2N5C24H31 |
A2B5C24D31 |
-38.38 |
2.8 |
-8.64 |
-0.19 |
0 |
|
|
339907 |
127261916 |
2 |
ON2C12H16 |
AB2C12D16 |
-62.38 |
5.94 |
-9.24 |
-0.17 |
0 |
|
|
339908 |
127261917 |
2 |
ON2C12H16 |
AB2C12D16 |
-57.06 |
3.03 |
-8.27 |
-0.12 |
0 |
|
|
339909 |
127261918 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-94.8 |
3.0 |
-9.07 |
-0.38 |
0 |
|
|
339910 |
127261919 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-85.39 |
3.18 |
-8.62 |
-0.07 |
0 |
|
|
339911 |
127261920 |
1 |
O3N4C27H32 |
A3B4C27D32 |
-54.76 |
3.64 |
-9.16 |
-0.4 |
0 |
|
|
339912 |
127261921 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-56.3 |
5.6 |
-8.96 |
0.28 |
0 |
|
|
339913 |
127261922 |
1 |
ClO2N4C21H27 |
AB2C4D21E27 |
-57.16 |
6.6 |
-8.67 |
-0.15 |
0 |
|
|
339914 |
127261923 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-99.32 |
4.36 |
-9.14 |
-0.24 |
0 |
|
|
339915 |
127261924 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-93.17 |
5.13 |
-8.68 |
0.17 |
0 |
|
|
339916 |
127261925 |
2 |
ON2C11H15 |
AB2C11D15 |
-59.66 |
2.52 |
-8.52 |
-0.02 |
0 |
|
|
339917 |
127261926 |
1 |
O3N4C27H32 |
A3B4C27D32 |
-59.76 |
4.04 |
-9.02 |
-0.32 |
0 |
|
|
339918 |
127261927 |
1 |
ClO2N4C21H27 |
AB2C4D21E27 |
-59.4 |
5.13 |
-8.66 |
-0.12 |
0 |
|
|
339919 |
127261928 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-96.37 |
5.71 |
-8.65 |
-0.07 |
0 |
|
|
339920 |
127261929 |
2 |
ON2C11H15 |
AB2C11D15 |
-58.77 |
2.25 |
-8.44 |
-0.03 |
0 |
|
|
339921 |
127261930 |
1 |
O3N4C27H32 |
A3B4C27D32 |
-56.55 |
4.83 |
-8.43 |
-0.1 |
0 |
|
|
339922 |
127261931 |
2 |
ON2C11H15 |
AB2C11D15 |
-50.4 |
6.15 |
-8.98 |
0.34 |
0 |
|
|
339923 |
127261932 |
1 |
N4O4C25H50 |
A4B4C25D50 |
-273.2 |
5.4 |
-9.31 |
0.1 |
0 |
|
|
339924 |
127261933 |
1 |
ClO2N4C22H29 |
AB2C4D22E29 |
-59.95 |
5.93 |
-9.0 |
0.07 |
0 |
|
|
339925 |
127261934 |
1 |
FO2N4C22H29 |
AB2C4D22E29 |
-96.91 |
6.93 |
-9.04 |
0.12 |
0 |
|
|
339926 |
127261935 |
1 |
O3N4C23H32 |
A3B4C23D32 |
-90.16 |
4.9 |
-9.25 |
-0.2 |
0 |
|
|
339927 |
127261936 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-60.64 |
4.68 |
-9.04 |
-0.18 |
0 |
|
|
339928 |
127261937 |
1 |
ClO2N4C22H29 |
AB2C4D22E29 |
-60.94 |
8.61 |
-9.11 |
0.08 |
0 |