List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
331906 |
127250192 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-29.79 |
5.9 |
-8.64 |
0.16 |
0 |
|
|
331907 |
127250193 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-60.58 |
8.46 |
-8.35 |
0.02 |
0 |
|
|
331908 |
127250194 |
1 |
SN4O4C22H24 |
AB4C4D22E24 |
-55.15 |
5.7 |
-8.4 |
-1.23 |
0 |
|
|
331909 |
127250195 |
1 |
SO2F3N4H19C21 |
AB2C3D4E19F21 |
-139.25 |
4.24 |
-9.68 |
-1.3 |
0 |
|
|
331910 |
127250196 |
1 |
F3O3N4H21C22 |
A3B3C4D21E22 |
-155.15 |
5.6 |
-9.66 |
-0.7 |
0 |
|
|
331911 |
127250197 |
1 |
SO2N3C22H23 |
AB2C3D22E23 |
-7.46 |
1.48 |
-8.98 |
-0.76 |
0 |
|
|
331912 |
127250198 |
1 |
SO2F3N3H20C22 |
AB2C3D3E20F22 |
-160.36 |
7.48 |
-9.43 |
-1.02 |
0 |
|
|
331913 |
127250199 |
1 |
O3N5C24H27 |
A3B5C24D27 |
-44.11 |
4.81 |
-8.81 |
-0.42 |
0 |
|
|
331914 |
127250200 |
1 |
O4N5C24H27 |
A4B5C24D27 |
-76.63 |
3.56 |
-8.28 |
-0.56 |
0 |
|
|
331915 |
127250201 |
1 |
ClN3O3C22H24 |
AB3C3D22E24 |
-88.08 |
2.85 |
-9.34 |
-0.27 |
0 |
|
|
331916 |
127250202 |
1 |
F3N3O3C23H24 |
A3B3C3D23E24 |
-240.71 |
3.23 |
-9.34 |
-0.62 |
0 |
|
|
331917 |
127250203 |
1 |
FO2N6C20H21 |
AB2C6D20E21 |
-2.27 |
7.14 |
-9.75 |
-0.5 |
0 |
|
|
331918 |
127250204 |
1 |
ClO2N6C20H21 |
AB2C6D20E21 |
35.41 |
5.03 |
-9.73 |
-0.51 |
0 |
|
|
331919 |
127250205 |
1 |
O2F3N6C21H21 |
A2B3C6D21E21 |
-117.26 |
6.35 |
-9.81 |
-0.82 |
0 |
|
|
331920 |
127250206 |
1 |
ClO2N5C23H26 |
AB2C5D23E26 |
-11.37 |
6.01 |
-9.47 |
-0.32 |
0 |
|
|
331921 |
127250207 |
1 |
ClO2N5C23H26 |
AB2C5D23E26 |
-11.73 |
6.01 |
-9.52 |
-0.39 |
0 |
|
|
331922 |
127250208 |
1 |
F3N3O3H22C23 |
A3B3C3D22E23 |
-210.35 |
5.98 |
-9.37 |
-0.72 |
0 |
|
|
331923 |
127250209 |
1 |
ClN3O3C20H22 |
AB3C3D20E22 |
-92.1 |
1.83 |
-9.39 |
-0.24 |
0 |
|
|
331924 |
127250210 |
1 |
ClN3O3C20H22 |
AB3C3D20E22 |
-92.0 |
3.52 |
-9.39 |
-0.31 |
0 |
|
|
331925 |
127250211 |
1 |
F3N3O3C21H22 |
A3B3C3D21E22 |
-246.37 |
4.17 |
-9.36 |
-0.61 |
0 |
|
|
331926 |
127250212 |
1 |
ON3H25C26 |
AB3C25D26 |
60.99 |
4.36 |
-8.88 |
-0.46 |
0 |
|
|
331927 |
127250213 |
1 |
FON4C21H23 |
ABC4D21E23 |
5.47 |
2.76 |
-8.86 |
-0.17 |
0 |
|
|
331928 |
127250214 |
2 |
ON2C11H13 |
AB2C11D13 |
12.97 |
3.8 |
-8.78 |
0.02 |
0 |
|
|
331929 |
127250215 |
1 |
FO2N3H26C27 |
AB2C3D26E27 |
-43.42 |
4.52 |
-8.62 |
-0.47 |
0 |
|
|
331930 |
127250216 |
1 |
ON4C21H24 |
AB4C21D24 |
52.38 |
4.06 |
-9.0 |
-0.16 |
0 |
|
|
331931 |
127250217 |
1 |
ON4C22H26 |
AB4C22D26 |
44.69 |
1.67 |
-9.15 |
-0.14 |
0 |
|
|
331932 |
127250218 |
2 |
ON2C11H13 |
AB2C11D13 |
12.23 |
3.98 |
-8.69 |
-0.14 |
0 |
|
|
331933 |
127250219 |
1 |
ClON4C21H23 |
ABC4D21E23 |
41.92 |
4.83 |
-9.04 |
-0.26 |
0 |
|
|
331934 |
127250220 |
1 |
ON4C24H30 |
AB4C24D30 |
27.88 |
2.57 |
-8.57 |
-0.06 |
0 |
|
|
331935 |
127250221 |
2 |
ON2C12H15 |
AB2C12D15 |
-2.65 |
2.73 |
-8.57 |
-0.07 |
0 |
|
|
331936 |
127250222 |
1 |
ClON4C23H27 |
ABC4D23E27 |
26.92 |
1.35 |
-8.62 |
-0.19 |
0 |
|
|
331937 |
127250223 |
1 |
O2N4C25H32 |
A2B4C25D32 |
-9.2 |
2.85 |
-8.56 |
0.0 |
0 |
|
|
331938 |
127250224 |
1 |
OF3N4C24H27 |
AB3C4D24E27 |
-125.56 |
3.67 |
-8.65 |
-0.64 |
0 |
|
|
331939 |
127250225 |
1 |
ClSO2N4C22H23 |
ABC2D4E22F23 |
-15.8 |
4.39 |
-8.72 |
-0.52 |
0 |
|
|
331940 |
127250226 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-40.35 |
2.37 |
-8.93 |
-0.09 |
0 |
|
|
331941 |
127250227 |
1 |
FO3N4C24H25 |
AB3C4D24E25 |
-108.83 |
2.57 |
-9.42 |
-0.45 |
0 |
|
|
331942 |
127250228 |
1 |
FO2N5C22H24 |
AB2C5D22E24 |
-42.32 |
3.06 |
-9.48 |
-0.42 |
0 |
|
|
331943 |
127250229 |
1 |
O2N4C27H28 |
A2B4C27D28 |
4.55 |
6.29 |
-8.85 |
-0.38 |
0 |
|
|
331944 |
127250230 |
1 |
O2F3N4H21C22 |
A2B3C4D21E22 |
-148.44 |
7.95 |
-9.29 |
-0.76 |
0 |
|
|
331945 |
127250231 |
2 |
ON2C12H13 |
AB2C12D13 |
-4.62 |
1.64 |
-8.74 |
-0.19 |
0 |
|
|
331946 |
127250232 |
1 |
FO2N4C23H23 |
AB2C4D23E23 |
-41.44 |
5.89 |
-8.92 |
-0.34 |
0 |
|
|
331947 |
127250233 |
1 |
FO2N4C23H23 |
AB2C4D23E23 |
-42.54 |
3.82 |
-8.78 |
-0.45 |
0 |
|
|
331948 |
127250234 |
1 |
ClO2N4C23H23 |
AB2C4D23E23 |
-4.67 |
5.96 |
-8.93 |
-0.34 |
0 |
|
|
331949 |
127250235 |
1 |
ClO2N4C23H23 |
AB2C4D23E23 |
-4.66 |
4.4 |
-8.94 |
-0.34 |
0 |
|
|
331950 |
127250236 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-73.32 |
3.46 |
-8.28 |
-0.32 |
0 |
|
|
331951 |
127250237 |
1 |
ClN3O3H22C23 |
AB3C3D22E23 |
-60.06 |
5.62 |
-9.26 |
-0.55 |
0 |
|
|
331952 |
127250238 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-49.97 |
2.47 |
-8.82 |
-0.57 |
0 |
|
|
331953 |
127250239 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-81.84 |
3.84 |
-8.32 |
-0.79 |
0 |
|
|
331954 |
127250240 |
1 |
SO2N3H25C26 |
AB2C3D25E26 |
4.24 |
2.99 |
-9.08 |
-1.02 |
0 |
|
|
331955 |
127250241 |
1 |
ClFO2N3H21C25 |
ABC2D3E21F25 |
-42.97 |
4.73 |
-9.0 |
-0.62 |
0 |
|
|
331956 |
127250242 |
1 |
ON4C22H26 |
AB4C22D26 |
46.6 |
3.28 |
-8.61 |
-0.11 |
0 |
|
|
331957 |
127250243 |
1 |
ON4C23H28 |
AB4C23D28 |
37.05 |
2.86 |
-8.62 |
-0.02 |
0 |
|
|
331958 |
127250244 |
1 |
O2N4C23H28 |
A2B4C23D28 |
5.75 |
3.44 |
-8.64 |
-0.03 |
0 |
|
|
331959 |
127250245 |
1 |
ClON4C22H25 |
ABC4D22E25 |
35.99 |
2.57 |
-8.7 |
-0.19 |
0 |
|
|
331960 |
127250246 |
1 |
FN3O3C22H22 |
AB3C3D22E22 |
-60.03 |
3.1 |
-9.55 |
-0.79 |
0 |
|
|
331961 |
127250247 |
1 |
F3N3O3H22C23 |
A3B3C3D22E23 |
-175.29 |
3.03 |
-9.57 |
-0.72 |
0 |
|
|
331962 |
127250248 |
4 |
NOC6H7 |
ABC6D7 |
-68.7 |
6.23 |
-8.21 |
-0.07 |
0 |
|
|
331963 |
127250249 |
1 |
ClO2N5H22C24 |
AB2C5D22E24 |
33.41 |
5.62 |
-9.15 |
-1.14 |
0 |
|
|
331964 |
127250250 |
1 |
FSO2N5C20H20 |
ABC2D5E20F20 |
-27.37 |
1.53 |
-9.35 |
-0.92 |
0 |
|
|
331965 |
127250251 |
1 |
O2N4C23H24 |
A2B4C23D24 |
-6.78 |
3.03 |
-8.98 |
-0.19 |
0 |
|
|
331966 |
127250252 |
1 |
ClO2N4H21C22 |
AB2C4D21E22 |
-7.38 |
0.85 |
-9.0 |
-0.25 |
0 |
|
|
331967 |
127250253 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-75.93 |
4.17 |
-8.3 |
-0.11 |
0 |
|
|
331968 |
127250254 |
1 |
O2F3N4H21C23 |
A2B3C4D21E23 |
-160.76 |
4.72 |
-9.13 |
-0.62 |
0 |
|
|
331969 |
127250255 |
1 |
O2F3N4H21C22 |
A2B3C4D21E22 |
-146.13 |
1.65 |
-9.39 |
-0.7 |
0 |
|
|
331970 |
127250256 |
1 |
FO2N4C26H29 |
AB2C4D26E29 |
-55.38 |
2.32 |
-8.97 |
-0.29 |
0 |
|
|
331971 |
127250257 |
1 |
ON3H25C26 |
AB3C25D26 |
63.94 |
1.89 |
-8.77 |
-0.61 |
0 |
|
|
331972 |
127250258 |
1 |
OF3N4C24H25 |
AB3C4D24E25 |
-121.15 |
0.73 |
-8.38 |
-0.63 |
0 |
|
|
331973 |
127250259 |
1 |
ON4C26H34 |
AB4C26D34 |
17.35 |
2.96 |
-8.54 |
0.09 |
0 |
|
|
331974 |
127250260 |
2 |
ON2C13H17 |
AB2C13D17 |
-19.58 |
4.57 |
-8.46 |
-0.11 |
0 |
|
|
331975 |
127250261 |
1 |
ClON4C25H31 |
ABC4D25E31 |
9.94 |
1.62 |
-8.52 |
-0.24 |
0 |
|
|
331976 |
127250262 |
1 |
O2N4C27H36 |
A2B4C27D36 |
-22.86 |
2.43 |
-8.64 |
0.28 |
0 |
|
|
331977 |
127250263 |
1 |
ON4C24H28 |
AB4C24D28 |
45.92 |
1.6 |
-8.54 |
-0.09 |
0 |
|
|
331978 |
127250264 |
2 |
ON2C13H16 |
AB2C13D16 |
4.6 |
2.02 |
-8.67 |
-0.08 |
0 |
|
|
331979 |
127250265 |
1 |
FO2N5C25H28 |
AB2C5D25E28 |
-62.84 |
5.51 |
-9.01 |
-0.28 |
0 |
|
|
331980 |
127250266 |
1 |
OSN3C21H23 |
ABC3D21E23 |
37.56 |
2.58 |
-8.91 |
-0.37 |
0 |