List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
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 |
|
|
359913 |
127300047 |
1 |
SN2F3O3C12H21 |
AB2C3D3E12F21 |
-297.53 |
3.63 |
-9.65 |
0.07 |
0 |
|
|
359914 |
127300048 |
1 |
SN2O4C17H32 |
AB2C4D17E32 |
-198.39 |
4.49 |
-8.89 |
0.44 |
0 |
|
|
359915 |
127300049 |
1 |
NSO3C12H23 |
ABC3D12E23 |
-158.66 |
5.05 |
-9.62 |
0.46 |
0 |
|
|
359916 |
127300050 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-109.69 |
10.61 |
-9.07 |
0.42 |
0 |
|
|
359917 |
127300051 |
1 |
SN2O4C12H24 |
AB2C4D12E24 |
-172.44 |
6.35 |
-8.72 |
0.17 |
0 |
|
|
359918 |
127300052 |
1 |
NSO4C11H21 |
ABC4D11E21 |
-183.84 |
5.14 |
-9.52 |
0.24 |
0 |
|
|
359919 |
127300053 |
1 |
SN2O5C15H26 |
AB2C5D15E26 |
-223.13 |
6.96 |
-9.42 |
0.36 |
0 |
|
|
359920 |
127300054 |
2 |
NSO2C7H12 |
ABC2D7E12 |
-175.43 |
6.45 |
-8.65 |
0.01 |
0 |
|
|
359921 |
127300055 |
1 |
NSO3C11H21 |
ABC3D11E21 |
-149.19 |
5.48 |
-9.63 |
0.43 |
0 |
|
|
359922 |
127300056 |
1 |
SN2O3C12H24 |
AB2C3D12E24 |
-118.76 |
4.97 |
-8.98 |
0.39 |
0 |
|
|
359923 |
127300057 |
1 |
NSO3C13H23 |
ABC3D13E23 |
-138.9 |
5.39 |
-9.63 |
0.4 |
0 |
|
|
359924 |
127300058 |
1 |
NSO5C16H21 |
ABC5D16E21 |
-173.49 |
5.93 |
-8.63 |
-0.03 |
0 |
|
|
359925 |
127300059 |
1 |
NSO3C11H21 |
ABC3D11E21 |
-153.62 |
5.61 |
-9.62 |
0.46 |
0 |
|
|
359926 |
127300060 |
1 |
SN2O4C13H26 |
AB2C4D13E26 |
-182.58 |
4.61 |
-8.84 |
0.3 |
0 |
|
|
359927 |
127300061 |
1 |
SN3O4C15H25 |
AB3C4D15E25 |
-149.7 |
5.17 |
-8.99 |
0.27 |
0 |
|
|
359928 |
127300062 |
1 |
N2S2O4C17H28 |
A2B2C4D17E28 |
-167.95 |
8.93 |
-9.33 |
0.03 |
0 |
|
|
359929 |
127300063 |
1 |
SN3O4C17H31 |
AB3C4D17E31 |
-197.42 |
2.47 |
-9.1 |
0.13 |
0 |
|
|
359930 |
127300064 |
1 |
SN3O4C14H23 |
AB3C4D14E23 |
-126.11 |
5.78 |
-9.69 |
-0.35 |
0 |
|
|
359931 |
127300065 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-94.11 |
7.85 |
-9.46 |
0.35 |
0 |
|
|
359932 |
127300066 |
1 |
SN3O4C17H31 |
AB3C4D17E31 |
-195.6 |
3.2 |
-9.05 |
0.16 |
0 |
|
|
359933 |
127300067 |
1 |
NS2O3C10H19 |
AB2C3D10E19 |
-138.69 |
5.25 |
-8.82 |
0.04 |
0 |
|
|
359934 |
127300068 |
1 |
SN2O4C15H28 |
AB2C4D15E28 |
-183.11 |
2.34 |
-8.96 |
0.25 |
0 |
|
|
359935 |
127300069 |
1 |
SN2O4C13H26 |
AB2C4D13E26 |
-185.04 |
5.49 |
-8.96 |
0.54 |
0 |
|
|
359936 |
127300070 |
1 |
SO3N4C14H24 |
AB3C4D14E24 |
-99.13 |
3.04 |
-8.97 |
0.23 |
0 |
|
|
359937 |
127300071 |
1 |
SO3N4C14H24 |
AB3C4D14E24 |
-88.47 |
5.72 |
-8.86 |
0.14 |
0 |