List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
314169 |
126620777 |
1 |
SN3O4C10H11 |
AB3C4D10E11 |
-113.35 |
2.65 |
-8.92 |
-0.99 |
0 |
|
|
314170 |
126620778 |
1 |
NH31C44 |
AB31C44 |
185.06 |
2.93 |
-8.2 |
-0.49 |
0 |
|
|
314171 |
126620779 |
1 |
NH45C68 |
AB45C68 |
281.8 |
2.97 |
-8.11 |
-0.84 |
0 |
|
|
314172 |
126620780 |
1 |
N4O12C37H68 |
A4B12C37D68 |
-610.39 |
7.57 |
-9.9 |
0.4 |
0 |
|
|
314173 |
126620787 |
1 |
NH39C62 |
AB39C62 |
257.71 |
2.41 |
-8.32 |
-0.8 |
0 |
|
|
314174 |
126620788 |
1 |
NH35C54 |
AB35C54 |
224.52 |
2.13 |
-8.28 |
-0.77 |
0 |
|
|
314175 |
126620792 |
1 |
INC10H14 |
ABC10D14 |
14.39 |
1.99 |
-8.42 |
-1.4 |
0 |
|
|
314176 |
126620793 |
1 |
NC22H31 |
AB22C31 |
-0.82 |
2.4 |
-7.61 |
0.74 |
0 |
|
|
314177 |
126620795 |
1 |
NO2H31C50 |
AB2C31D50 |
159.57 |
3.71 |
-8.13 |
-0.9 |
0 |
|
|
314178 |
126620796 |
1 |
SO2N5H19C21 |
AB2C5D19E21 |
45.18 |
6.51 |
-9.14 |
-0.95 |
0 |
|
|
314179 |
126620797 |
1 |
NSH51C72 |
ABC51D72 |
315.76 |
9.25 |
-6.6 |
-0.48 |
0 |
|
|
314180 |
126620810 |
1 |
SO2N5H17C21 |
AB2C5D17E21 |
45.0 |
6.48 |
-9.05 |
-1.01 |
0 |
|
|
314181 |
126620812 |
1 |
SO2N4H18C23 |
AB2C4D18E23 |
31.66 |
7.48 |
-8.52 |
-1.14 |
0 |
|
|
314182 |
126620814 |
1 |
INC14H16 |
ABC14D16 |
40.03 |
2.39 |
-8.27 |
-1.78 |
0 |
|
|
314183 |
126620824 |
1 |
N2C9H20 |
A2B9C20 |
-12.83 |
2.58 |
-8.78 |
1.29 |
0 |
|
|
314184 |
126620826 |
1 |
NH29C44 |
AB29C44 |
188.34 |
3.05 |
-8.21 |
-0.88 |
0 |
|
|
314185 |
126620827 |
1 |
NH43C64 |
AB43C64 |
263.7 |
1.99 |
-8.11 |
-0.74 |
0 |
|
|
314186 |
126620828 |
1 |
NO6C29H37 |
AB6C29D37 |
-240.0 |
4.64 |
-8.82 |
0.13 |
0 |
|
|
314187 |
126620829 |
1 |
FNH30C44 |
ABC30D44 |
137.15 |
1.78 |
-8.21 |
-0.81 |
0 |
|
|
314188 |
126620830 |
1 |
FNH30C44 |
ABC30D44 |
136.7 |
0.86 |
-8.25 |
-0.69 |
0 |
|
|
314189 |
126620831 |
1 |
NSH43C53 |
ABC43D53 |
234.58 |
6.76 |
-7.08 |
-0.26 |
0 |
|
|
314190 |
126620832 |
1 |
N2H34C51 |
A2B34C51 |
239.38 |
2.29 |
-8.31 |
-1.04 |
0 |
|
|
314191 |
126620844 |
2 |
PC3H8 |
AB3C8 |
-46.31 |
0.55 |
-8.23 |
2.3 |
0 |
|
|
314192 |
126620849 |
1 |
NI2C9H11 |
AB2C9D11 |
34.14 |
1.39 |
-8.49 |
-2.85 |
0 |
|
|
314193 |
126620851 |
1 |
SN3O4C13H15 |
AB3C4D13E15 |
-78.39 |
10.98 |
-8.49 |
-1.78 |
0 |
|
|
314194 |
126620853 |
1 |
SO3N5H19C21 |
AB3C5D19E21 |
-33.53 |
10.11 |
-8.9 |
-0.97 |
0 |
|
|
314195 |
126620874 |
1 |
SN3O5C11H11 |
AB3C5D11E11 |
-124.34 |
8.31 |
-9.11 |
-1.98 |
0 |
|
|
314196 |
126620875 |
1 |
PC13H21 |
AB13C21 |
7.25 |
1.92 |
-8.46 |
0.53 |
0 |
|
|
314197 |
126620877 |
1 |
SO4N5H17C18 |
AB4C5D17E18 |
-40.03 |
7.77 |
-9.29 |
-1.29 |
0 |
|
|
314198 |
126620878 |
1 |
SO2N4C15H18 |
AB2C4D15E18 |
-1.32 |
10.92 |
-8.53 |
-0.69 |
0 |
|
|
314199 |
126620893 |
1 |
NSO3C29H39 |
ABC3D29E39 |
-45.9 |
3.62 |
-8.88 |
-0.46 |
0 |
|
|
314200 |
126620895 |
1 |
OSN2C24H28 |
ABC2D24E28 |
13.79 |
0.54 |
-8.03 |
-0.18 |
0 |
|
|
314201 |
126620896 |
1 |
OSN2C18H22 |
ABC2D18E22 |
-6.96 |
2.1 |
-8.21 |
-0.11 |
0 |
|
|
314202 |
126620897 |
1 |
NPC21H44 |
ABC21D44 |
-83.91 |
3.01 |
-8.46 |
3.09 |
0 |
|
|
314203 |
126620898 |
2 |
NO2C6H8 |
AB2C6D8 |
-80.63 |
5.71 |
-9.58 |
-1.21 |
0 |
|
|
314204 |
126620899 |
1 |
FNO7C24H30 |
ABC7D24E30 |
-331.6 |
2.51 |
-8.77 |
-0.46 |
0 |
|
|
314205 |
126620900 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-67.94 |
5.24 |
-8.74 |
0.02 |
0 |
|
|
314206 |
126620901 |
2 |
N2C15H28 |
A2B15C28 |
-75.65 |
2.83 |
-8.21 |
3.11 |
0 |
|
|
314207 |
126620904 |
1 |
OSN2C24H28 |
ABC2D24E28 |
8.32 |
1.31 |
-8.23 |
-0.08 |
0 |
|
|
314208 |
126620907 |
1 |
OF2N4C12H16 |
AB2C4D12E16 |
-62.23 |
2.28 |
-8.69 |
-1.04 |
0 |
|
|
314209 |
126620926 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-79.41 |
4.38 |
-8.34 |
-0.06 |
0 |
|
|
314210 |
126620927 |
1 |
N3O3C17H35 |
A3B3C17D35 |
-200.46 |
1.78 |
-9.16 |
0.56 |
0 |
|
|
314211 |
126620930 |
1 |
NSC12H19 |
ABC12D19 |
-18.14 |
3.35 |
-8.13 |
0.38 |
0 |
|
|
314212 |
126620934 |
1 |
SO3N7H25C27 |
AB3C7D25E27 |
66.14 |
2.91 |
-8.44 |
-1.07 |
0 |
|
|
314213 |
126620935 |
1 |
SO2N7H25C27 |
AB2C7D25E27 |
91.05 |
5.58 |
-8.61 |
-1.08 |
0 |
|
|
314214 |
126620937 |
1 |
ClSO2N5C19H20 |
ABC2D5E19F20 |
23.04 |
2.79 |
-8.75 |
-1.41 |
0 |
|
|
314215 |
126620938 |
1 |
ClNOSC4H8 |
ABCDE4F8 |
-17.67 |
3.24 |
-8.7 |
-0.23 |
0 |
|
|
314216 |
126620940 |
1 |
ClNSO2C5H8 |
ABCD2E5F8 |
-60.71 |
4.24 |
-10.08 |
-0.45 |
0 |
|
|
314217 |
126620941 |
1 |
ClSO4N5C19H20 |
ABC4D5E19F20 |
-56.42 |
5.49 |
-9.18 |
-1.51 |
0 |
|
|
314218 |
126620943 |
1 |
NSO3C7H11 |
ABC3D7E11 |
-108.28 |
4.1 |
-8.79 |
0.46 |
0 |
|
|
314219 |
126620946 |
1 |
BrN2H5C9 |
AB2C5D9 |
74.99 |
7.13 |
-9.18 |
-0.92 |
0 |
|
|
314220 |
126620947 |
1 |
SO4N6C26H26 |
AB4C6D26E26 |
-23.49 |
5.91 |
-8.59 |
-1.28 |
0 |
|
|
314221 |
126620949 |
1 |
FSO3N6H25C26 |
ABC3D6E25F26 |
-13.43 |
5.24 |
-8.51 |
-1.25 |
0 |
|
|
314222 |
126620951 |
2 |
OSN3C13H13 |
ABC3D13E13 |
58.43 |
2.6 |
-8.44 |
-1.16 |
0 |
|
|
314223 |
126620953 |
1 |
FSO3N6C27H29 |
ABC3D6E27F29 |
-17.3 |
4.16 |
-8.4 |
-0.93 |
0 |
|
|
314224 |
126620954 |
1 |
FSO3N6H25C26 |
ABC3D6E25F26 |
-11.52 |
2.25 |
-8.51 |
-1.13 |
0 |
|
|
314225 |
126620955 |
1 |
NSC10H21 |
ABC10D21 |
-23.41 |
2.49 |
-8.32 |
1.04 |
0 |
|
|
314226 |
126620956 |
1 |
NSC11H23 |
ABC11D23 |
-16.06 |
1.33 |
-8.3 |
0.99 |
0 |
|
|
314228 |
126620958 |
1 |
NSO3C28H43 |
ABC3D28E43 |
-121.45 |
3.09 |
-8.92 |
-0.21 |
0 |
|
|
314229 |
126620972 |
1 |
NSC23H29 |
ABC23D29 |
27.42 |
3.2 |
-8.0 |
0.11 |
0 |
|
|
314230 |
126620973 |
1 |
NO2C18H25 |
AB2C18D25 |
-87.6 |
2.76 |
-8.99 |
-0.2 |
0 |
|
|
314231 |
126620974 |
1 |
NSO4C30H47 |
ABC4D30E47 |
-204.51 |
2.76 |
-9.04 |
-0.15 |
0 |
|
|
314232 |
126620975 |
1 |
INSO5C28H40 |
ABCD5E28F40 |
-211.8 |
2.33 |
-9.36 |
-2.09 |
0 |
|
|
314233 |
126620976 |
1 |
NO2C17H23 |
AB2C17D23 |
-79.39 |
3.15 |
-8.94 |
-0.18 |
0 |
|
|
314234 |
126620977 |
1 |
FN6O6C22H25 |
AB6C6D22E25 |
-242.32 |
10.9 |
-9.04 |
-1.26 |
0 |
|
|
314235 |
126620978 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-39.52 |
7.47 |
-9.3 |
-0.45 |
0 |
|
|
314236 |
126620981 |
1 |
ClN3C6H10 |
AB3C6D10 |
8.85 |
2.33 |
-9.56 |
-0.33 |
0 |
|
|
314237 |
126620982 |
1 |
INOC9H10 |
ABCD9E10 |
1.66 |
0.87 |
-8.19 |
-1.71 |
0 |
|
|
314238 |
126620986 |
1 |
SF3O3N6H25C27 |
AB3C3D6E25F27 |
-128.5 |
4.09 |
-8.51 |
-1.28 |
0 |
|
|
314239 |
126621001 |
1 |
BrNO3C13H14 |
ABC3D13E14 |
-107.66 |
4.69 |
-8.68 |
-0.68 |
0 |
|
|
314240 |
126621002 |
1 |
NOSF2C3H3 |
ABCD2E3F3 |
-114.08 |
2.95 |
-8.88 |
-0.86 |
0 |
|
|
314241 |
126621003 |
1 |
ClSO4N5C19H22 |
ABC4D5E19F22 |
-74.88 |
4.75 |
-9.2 |
-1.57 |
0 |
|
|
314242 |
126621004 |
1 |
ClSO3N6C18H21 |
ABC3D6E18F21 |
-0.8 |
2.84 |
-9.14 |
-1.49 |
0 |
|
|
314243 |
126621005 |
1 |
NOS2C5H9 |
ABC2D5E9 |
-44.19 |
4.92 |
-8.67 |
-0.87 |
0 |
|
|
314244 |
126621006 |
1 |
NOSC5H9 |
ABCD5E9 |
-35.28 |
4.36 |
-9.21 |
-0.18 |
0 |