List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
323034 |
126671851 |
1 |
ClS2O5N10C50H51 |
AB2C5D10E50F51 |
-3.81 |
9.12 |
-8.84 |
-1.26 |
0 |
|
|
323035 |
126671870 |
1 |
ClS2O6N12C53H63 |
AB2C6D12E53F63 |
-88.59 |
9.12 |
-8.84 |
-1.36 |
0 |
|
|
323036 |
126671872 |
1 |
ClFS2O6N8C56H62 |
ABC2D6E8F56G62 |
-198.55 |
14.08 |
-9.14 |
-1.27 |
0 |
|
|
323037 |
126671873 |
1 |
O4N5C25H31 |
A4B5C25D31 |
-76.78 |
2.61 |
-8.64 |
-0.54 |
0 |
|
|
323038 |
126671876 |
1 |
ClSO5N11C54H58 |
ABC5D11E54F58 |
-15.8 |
6.74 |
-8.47 |
-1.25 |
0 |
|
|
323039 |
126671882 |
1 |
O3N5C22H25 |
A3B5C22D25 |
-50.9 |
5.97 |
-8.62 |
-0.6 |
0 |
|
|
323040 |
126671883 |
1 |
ON2C24H32 |
AB2C24D32 |
-11.74 |
1.42 |
-8.28 |
0.14 |
0 |
|
|
323041 |
126671886 |
1 |
ON2C26H36 |
AB2C26D36 |
-20.53 |
1.68 |
-8.45 |
0.11 |
0 |
|
|
323042 |
126671887 |
1 |
O2N7C36H45 |
A2B7C36D45 |
10.56 |
1.97 |
-8.44 |
-0.64 |
0 |
|
|
323043 |
126671889 |
1 |
N2O2C25H34 |
A2B2C25D34 |
-51.83 |
2.83 |
-8.09 |
0.07 |
0 |
|
|
323044 |
126671890 |
1 |
ON2C26H34 |
AB2C26D34 |
4.52 |
1.41 |
-8.21 |
-0.05 |
0 |
|
|
323045 |
126671891 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-26.58 |
7.79 |
-9.44 |
-0.8 |
0 |
|
|
323046 |
126671895 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-40.21 |
7.54 |
-8.89 |
-0.72 |
0 |
|
|
323047 |
126671898 |
1 |
NO2C20H25 |
AB2C20D25 |
-3.6 |
4.54 |
-9.24 |
-0.74 |
0 |
|
|
323048 |
126671899 |
1 |
FCl2N2O3H7C13 |
AB2C2D3E7F13 |
-115.28 |
4.83 |
-9.57 |
-1.58 |
0 |
|
|
323049 |
126671902 |
1 |
NO4C14H21 |
AB4C14D21 |
-143.81 |
2.55 |
-8.05 |
0.15 |
0 |
|
|
323050 |
126671903 |
1 |
NO5C16H25 |
AB5C16D25 |
-181.09 |
2.58 |
-8.02 |
0.18 |
0 |
|
|
323051 |
126671904 |
1 |
NO5C20H33 |
AB5C20D33 |
-203.19 |
2.23 |
-7.86 |
0.32 |
0 |
|
|
323052 |
126671905 |
1 |
FNO4C16H24 |
ABC4D16E24 |
-195.63 |
1.38 |
-8.04 |
0.08 |
0 |
|
|
323053 |
126671908 |
1 |
NO6C18H29 |
AB6C18D29 |
-225.06 |
3.0 |
-7.97 |
0.22 |
0 |
|
|
323054 |
126671909 |
1 |
NO4C16H25 |
AB4C16D25 |
-150.48 |
0.78 |
-7.86 |
0.32 |
0 |
|
|
323055 |
126671916 |
1 |
NO2C14H19 |
AB2C14D19 |
-54.03 |
3.72 |
-9.06 |
-0.72 |
0 |
|
|
323056 |
126671921 |
1 |
FNO2C16H24 |
ABC2D16E24 |
-136.47 |
4.29 |
-9.18 |
0.05 |
0 |
|
|
323057 |
126671923 |
1 |
FNO2C16H24 |
ABC2D16E24 |
-133.27 |
6.08 |
-8.79 |
0.03 |
0 |
|
|
323058 |
126671941 |
1 |
NSF3C7H8 |
ABC3D7E8 |
-140.33 |
4.95 |
-10.16 |
-1.05 |
0 |
|
|
323059 |
126671950 |
1 |
ClS2O6N10C53H67 |
AB2C6D10E53F67 |
-158.25 |
6.05 |
-9.21 |
-1.26 |
0 |
|
|
323060 |
126671986 |
1 |
ClSO6N10C54H63 |
ABC6D10E54F63 |
-97.57 |
12.22 |
-8.97 |
-1.5 |
0 |
|
|
323061 |
126671987 |
1 |
ClS2O7N8C51H61 |
AB2C7D8E51F61 |
-196.61 |
9.67 |
-8.91 |
-1.53 |
0 |
|
|
323062 |
126671994 |
1 |
ClSO7N10C53H59 |
ABC7D10E53F59 |
-135.84 |
5.66 |
-9.08 |
-1.55 |
0 |
|
|
323063 |
126671996 |
1 |
FNO2C14H20 |
ABC2D14E20 |
-130.03 |
3.0 |
-9.11 |
-0.01 |
0 |
|
|
323064 |
126672002 |
1 |
NO3C14H17 |
AB3C14D17 |
-77.53 |
4.48 |
-8.81 |
-1.02 |
0 |
|
|
323065 |
126672014 |
1 |
ClS3O6N9C48H58 |
AB3C6D9E48F58 |
-153.87 |
12.26 |
-9.02 |
-1.54 |
0 |
|
|
323066 |
126672044 |
1 |
SN2O2H10C11 |
AB2C2D10E11 |
-6.25 |
2.45 |
-9.7 |
-1.55 |
0 |
|
|
323067 |
126672047 |
1 |
FO2N7H22C25 |
AB2C7D22E25 |
15.74 |
4.35 |
-8.49 |
-1.26 |
0 |
|
|
323068 |
126672050 |
1 |
IO2C19H29 |
AB2C19D29 |
-100.38 |
1.33 |
-8.69 |
-0.54 |
0 |
|
|
323069 |
126672061 |
1 |
NO2C9H15 |
AB2C9D15 |
-68.71 |
2.99 |
-9.9 |
0.61 |
0 |
|
|
323071 |
126672083 |
1 |
FO4N6H21C23 |
AB4C6D21E23 |
-64.24 |
5.01 |
-8.62 |
-1.42 |
0 |
|
|
323072 |
126672091 |
1 |
FO5N7C33H38 |
AB5C7D33E38 |
-177.93 |
5.89 |
-8.47 |
-1.38 |
0 |
|
|
323073 |
126672095 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-87.58 |
2.15 |
-8.25 |
-0.04 |
0 |
|
|
323074 |
126672099 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-121.01 |
5.83 |
-8.31 |
1.08 |
0 |
|
|
323075 |
126672100 |
1 |
ON2C13H26 |
AB2C13D26 |
-63.85 |
2.57 |
-8.63 |
2.18 |
0 |
|
|
323076 |
126672103 |
1 |
ON3C9H15 |
AB3C9D15 |
-14.33 |
4.05 |
-8.7 |
0.63 |
0 |
|
|
323077 |
126672110 |
1 |
NSC7H11 |
ABC7D11 |
9.61 |
0.54 |
-8.95 |
0.04 |
0 |
|
|
323078 |
126672134 |
1 |
NSC16H19 |
ABC16D19 |
29.12 |
4.51 |
-8.56 |
-0.25 |
0 |
|
|
323079 |
126672135 |
1 |
BrNSO2H10C14 |
ABCD2E10F14 |
5.37 |
3.48 |
-8.88 |
-0.91 |
0 |
|
|
323080 |
126672147 |
1 |
SO3N4C24H26 |
AB3C4D24E26 |
-14.27 |
5.98 |
-8.32 |
-0.73 |
0 |
|
|
323081 |
126672153 |
1 |
FO3N6H19C22 |
AB3C6D19E22 |
-37.18 |
1.28 |
-8.64 |
-1.35 |
0 |
|
|
323082 |
126672157 |
1 |
SN4C6H10 |
AB4C6D10 |
64.35 |
5.9 |
-8.69 |
-1.06 |
0 |
|
|
323083 |
126672159 |
1 |
SO10N15C45H57 |
AB10C15D45E57 |
-222.22 |
11.36 |
-8.78 |
-1.35 |
0 |
|
|
323084 |
126672184 |
1 |
NOC17H35 |
ABC17D35 |
-124.2 |
3.52 |
-9.73 |
1.27 |
0 |