List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
358935 |
127296826 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-131.63 |
5.97 |
-9.38 |
1.18 |
0 |
|
|
358936 |
127296827 |
2 |
NOC7H13 |
ABC7D13 |
-125.79 |
2.82 |
-9.27 |
1.38 |
0 |
|
|
358937 |
127296828 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-127.6 |
4.03 |
-9.16 |
1.06 |
0 |
|
|
358938 |
127296829 |
1 |
ON4C16H24 |
AB4C16D24 |
-43.93 |
4.47 |
-9.67 |
-0.35 |
0 |
|
|
358939 |
127296830 |
2 |
ON2C10H18 |
AB2C10D18 |
-133.1 |
6.15 |
-8.83 |
0.99 |
0 |
|
|
358940 |
127296831 |
1 |
SO3N4C14H22 |
AB3C4D14E22 |
-84.43 |
8.76 |
-9.5 |
-0.36 |
0 |
|
|
358941 |
127296832 |
1 |
SO4N5C17H27 |
AB4C5D17E27 |
-147.27 |
13.31 |
-9.06 |
-0.6 |
0 |
|
|
358942 |
127296833 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-93.45 |
2.4 |
-9.13 |
-0.98 |
0 |
|
|
358943 |
127296834 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-137.34 |
3.1 |
-9.69 |
-0.17 |
0 |
|
|
358944 |
127296835 |
1 |
O2N4C11H22 |
A2B4C11D22 |
-105.11 |
5.38 |
-9.2 |
0.96 |
0 |
|
|
358945 |
127296836 |
2 |
NOC7H10 |
ABC7D10 |
-98.45 |
2.17 |
-9.8 |
0.18 |
0 |
|
|
358946 |
127296837 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-91.62 |
2.57 |
-9.75 |
0.21 |
0 |
|
|
358947 |
127296838 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-86.79 |
5.38 |
-9.5 |
-0.06 |
0 |
|
|
358948 |
127296839 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-66.78 |
3.56 |
-8.91 |
-1.18 |
0 |
|
|
358949 |
127296840 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-94.62 |
3.68 |
-9.46 |
0.01 |
0 |
|
|
358951 |
127296842 |
1 |
SN2O2C12H16 |
AB2C2D12E16 |
-80.77 |
1.82 |
-9.04 |
-0.14 |
0 |
|
|
358952 |
127296843 |
1 |
OSN6C10H16 |
ABC6D10E16 |
-0.48 |
3.15 |
-9.32 |
-0.47 |
0 |
|
|
358954 |
127296845 |
1 |
OS2N3C17H21 |
AB2C3D17E21 |
-4.67 |
5.15 |
-8.89 |
-1.12 |
0 |
|
|
358955 |
127296846 |
1 |
OS2N3C16H19 |
AB2C3D16E19 |
8.82 |
3.12 |
-8.57 |
-0.92 |
0 |
|
|
358956 |
127296847 |
1 |
SN3O4C16H23 |
AB3C4D16E23 |
-152.49 |
3.94 |
-9.65 |
-0.9 |
0 |
|
|
358957 |
127296848 |
1 |
S2N3O3C17H25 |
A2B3C3D17E25 |
-107.71 |
5.01 |
-9.31 |
-1.21 |
0 |
|
|
358958 |
127296849 |
1 |
S2N3O4C16H23 |
A2B3C4D16E23 |
-129.92 |
5.91 |
-9.45 |
-1.32 |
0 |
|
|
358959 |
127296850 |
1 |
S2N3O3C16H23 |
A2B3C3D16E23 |
-96.3 |
3.83 |
-9.39 |
-1.32 |
0 |
|
|
358960 |
127296851 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-88.63 |
2.43 |
-9.69 |
0.14 |
0 |
|
|
358961 |
127296852 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-136.49 |
6.58 |
-9.72 |
-0.27 |
0 |
|
|
358962 |
127296853 |
1 |
OSN3C17H21 |
ABC3D17E21 |
-2.56 |
6.08 |
-9.04 |
-1.03 |
0 |
|
|
358964 |
127296855 |
1 |
SN3O3C14H17 |
AB3C3D14E17 |
-79.56 |
3.94 |
-9.53 |
-1.22 |
0 |
|
|
358965 |
127296856 |
1 |
O2S2N4C13H20 |
A2B2C4D13E20 |
-27.7 |
5.0 |
-8.81 |
-1.11 |
0 |
|
|
358966 |
127296857 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-123.48 |
1.74 |
-9.93 |
0.0 |
0 |
|
|
358967 |
127296858 |
1 |
N3O4C15H19 |
A3B4C15D19 |
-124.27 |
3.67 |
-9.54 |
-0.19 |
0 |
|
|
358968 |
127296859 |
1 |
SN2O2C13H18 |
AB2C2D13E18 |
-87.29 |
0.93 |
-8.79 |
-0.02 |
0 |
|
|
358969 |
127296860 |
1 |
O2S2N5C16H25 |
A2B2C5D16E25 |
-43.33 |
2.16 |
-8.33 |
-0.64 |
0 |
|
|
358970 |
127296861 |
1 |
OS2N5C14H23 |
AB2C5D14E23 |
19.29 |
5.92 |
-8.62 |
-1.01 |
0 |
|
|
358971 |
127296862 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-40.34 |
2.81 |
-8.98 |
-0.53 |
0 |
|
|
358972 |
127296863 |
1 |
O2N3C23H25 |
A2B3C23D25 |
10.88 |
4.54 |
-8.91 |
-0.47 |
0 |
|
|
358973 |
127296864 |
1 |
ON5C23H25 |
AB5C23D25 |
49.87 |
2.95 |
-9.6 |
-1.43 |
0 |
|
|
358974 |
127296865 |
1 |
ON4C22H22 |
AB4C22D22 |
64.17 |
2.8 |
-9.13 |
-0.74 |
0 |
|
|
358975 |
127296866 |
1 |
O2N4C23H24 |
A2B4C23D24 |
18.45 |
5.09 |
-9.15 |
-0.89 |
0 |
|
|
358976 |
127296867 |
1 |
ON5C21H23 |
AB5C21D23 |
55.65 |
3.13 |
-9.65 |
-1.4 |
0 |
|
|
358977 |
127296868 |
1 |
O2N3C24H27 |
A2B3C24D27 |
10.38 |
1.88 |
-8.88 |
-0.45 |
0 |
|
|
358978 |
127296869 |
1 |
SO3N5C17H23 |
AB3C5D17E23 |
-60.39 |
8.6 |
-9.22 |
-1.24 |
0 |
|
|
358979 |
127296870 |
1 |
O2N4C11H12 |
A2B4C11D12 |
-8.01 |
3.45 |
-9.19 |
-1.01 |
0 |
|
|
358980 |
127296871 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-96.25 |
7.27 |
-8.91 |
-0.03 |
0 |
|
|
358981 |
127296872 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-60.84 |
4.84 |
-8.58 |
-1.27 |
0 |
|
|
358982 |
127296873 |
2 |
NSO2C9H13 |
ABC2D9E13 |
-158.08 |
7.9 |
-8.68 |
-0.43 |
0 |
|
|
358983 |
127296874 |
1 |
SO3N5C15H17 |
AB3C5D15E17 |
-14.58 |
5.77 |
-9.33 |
-1.34 |
0 |
|
|
358984 |
127296875 |
1 |
SO3N5C16H21 |
AB3C5D16E21 |
-54.56 |
4.48 |
-9.3 |
-1.29 |
0 |
|
|
358985 |
127296876 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-106.1 |
4.5 |
-8.65 |
-0.22 |
0 |
|
|
358986 |
127296877 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-171.63 |
6.12 |
-8.71 |
-0.24 |
0 |
|
|
358987 |
127296878 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-32.03 |
7.6 |
-8.65 |
0.24 |
0 |
|
|
358988 |
127296879 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-45.0 |
1.01 |
-8.81 |
-0.37 |
0 |
|
|
358989 |
127297181 |
1 |
N3O4C18H31 |
A3B4C18D31 |
-193.83 |
4.63 |
-9.08 |
0.55 |
0 |
|
|
358990 |
127297182 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-91.2 |
3.48 |
-9.19 |
-0.2 |
0 |
|
|
358991 |
127297183 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-51.94 |
5.27 |
-9.32 |
-1.4 |
0 |
|
|
358992 |
127297184 |
1 |
N3O3C20H35 |
A3B3C20D35 |
-173.79 |
5.33 |
-9.1 |
0.8 |
0 |
|
|
358993 |
127297185 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-165.6 |
7.46 |
-9.26 |
0.41 |
0 |
|
|
358994 |
127297186 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-135.53 |
3.52 |
-8.74 |
0.05 |
0 |
|
|
358995 |
127297187 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-69.55 |
4.55 |
-9.23 |
-0.71 |
0 |
|
|
358996 |
127297188 |
1 |
O2N7C16H27 |
A2B7C16D27 |
-31.0 |
1.84 |
-9.41 |
-0.8 |
0 |
|
|
358997 |
127297189 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-152.83 |
2.52 |
-9.12 |
-0.42 |
0 |
|
|
358998 |
127297190 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-173.78 |
4.27 |
-9.24 |
0.59 |
0 |
|
|
358999 |
127297243 |
1 |
FN3O3C19H26 |
AB3C3D19E26 |
-159.21 |
7.97 |
-8.76 |
-0.71 |
0 |
|
|
359000 |
127297244 |
2 |
ON2C11H16 |
AB2C11D16 |
-59.8 |
5.07 |
-8.6 |
-0.31 |
0 |
|
|
359001 |
127297245 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-119.77 |
7.31 |
-8.34 |
-0.94 |
0 |
|
|
359002 |
127297246 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-164.03 |
1.36 |
-8.75 |
0.63 |
0 |
|
|
359003 |
127297247 |
2 |
ON2C10H16 |
AB2C10D16 |
-72.42 |
5.83 |
-8.48 |
0.11 |
0 |
|
|
359004 |
127297248 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-127.26 |
3.59 |
-8.52 |
-0.78 |
0 |
|
|
359005 |
127297249 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-120.7 |
5.76 |
-8.78 |
-0.96 |
0 |
|
|
359006 |
127297250 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-185.44 |
3.23 |
-8.28 |
0.6 |
0 |
|
|
359007 |
127297251 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-144.22 |
2.71 |
-8.65 |
-0.61 |
0 |
|
|
359008 |
127297252 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-31.27 |
5.25 |
-8.8 |
-1.28 |
0 |
|
|
359009 |
127297253 |
1 |
FSN2O2C19H25 |
ABC2D2E19F25 |
-138.03 |
3.52 |
-9.35 |
-0.26 |
0 |
|
|
359010 |
127297254 |
1 |
SN2O5C19H28 |
AB2C5D19E28 |
-201.57 |
7.55 |
-9.14 |
-0.5 |
0 |
|
|
359011 |
127297255 |
1 |
ClN3O3C15H16 |
AB3C3D15E16 |
-115.74 |
3.44 |
-9.06 |
-0.39 |
0 |
|
|
359012 |
127297256 |
1 |
ClO3N4C19H25 |
AB3C4D19E25 |
-137.65 |
6.18 |
-9.01 |
-0.16 |
0 |