List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
165892 |
74610381 |
1 |
O2N5C23H42 |
A2B5C23D42 |
-51.3 |
5.62 |
0.0 |
0.0 |
1 |
|
|
165893 |
74610382 |
1 |
O2N3C23H36 |
A2B3C23D36 |
-82.04 |
7.52 |
0.0 |
0.0 |
0 |
|
|
165894 |
74610383 |
1 |
ON3C19H35 |
AB3C19D35 |
-78.92 |
3.91 |
-8.55 |
1.1 |
1 |
|
|
165895 |
74610384 |
1 |
O2N5C18H28 |
A2B5C18D28 |
51.87 |
5.18 |
0.0 |
0.0 |
0 |
|
|
165896 |
74610385 |
1 |
O2N5C18H27 |
A2B5C18D27 |
12.67 |
4.32 |
-8.79 |
-0.44 |
1 |
|
|
165897 |
74610460 |
1 |
SN3O3C25H34 |
AB3C3D25E34 |
-53.75 |
4.61 |
0.0 |
0.0 |
0 |
|
|
165898 |
74610826 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-85.81 |
4.82 |
-8.95 |
-0.19 |
0 |
|
|
165899 |
74610856 |
1 |
FSN4O4C21H29 |
ABC4D4E21F29 |
-225.09 |
4.02 |
-8.94 |
-0.24 |
0 |
|
|
165900 |
74610857 |
1 |
FSO2N3C18H24 |
ABC2D3E18F24 |
-130.76 |
6.3 |
-8.86 |
-0.19 |
0 |
|
|
165901 |
74610983 |
1 |
FSN3O3C21H24 |
ABC3D3E21F24 |
-134.83 |
3.03 |
-8.75 |
-0.19 |
0 |
|
|
165902 |
74610984 |
1 |
FO2S2N3C20H22 |
AB2C2D3E20F22 |
-92.76 |
6.64 |
-8.31 |
-0.54 |
0 |
|
|
165903 |
74611594 |
2 |
NO2C11H12 |
AB2C11D12 |
-109.35 |
8.3 |
-8.7 |
-0.68 |
0 |
|
|
165904 |
74611755 |
1 |
FO2N3C21H30 |
AB2C3D21E30 |
-137.48 |
4.18 |
-8.76 |
-0.11 |
0 |
|
|
165905 |
74612427 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
5.23 |
5.71 |
-8.74 |
-0.1 |
0 |
|
|
165906 |
74612428 |
1 |
N4O5C23H28 |
A4B5C23D28 |
-146.96 |
4.13 |
-8.93 |
-0.18 |
1 |
|
|
165907 |
74612429 |
1 |
SO3N6C21H23 |
AB3C6D21E23 |
21.49 |
3.9 |
0.0 |
0.0 |
0 |
|
|
165908 |
74612430 |
1 |
SO3N6C21H22 |
AB3C6D21E22 |
48.87 |
4.59 |
-8.9 |
-1.66 |
1 |
|
|
165909 |
74612472 |
1 |
ClSN3O3C21H23 |
ABC3D3E21F23 |
-39.51 |
3.8 |
0.0 |
0.0 |
0 |
|
|
165910 |
74612958 |
1 |
SN3O4C22H23 |
AB3C4D22E23 |
-104.47 |
9.23 |
-8.6 |
-0.67 |
1 |
|
|
165911 |
74613107 |
1 |
IN2O2C20H24 |
AB2C2D20E24 |
-15.32 |
14.3 |
0.0 |
0.0 |
1 |
|
|
165912 |
74613108 |
1 |
Cl2N2O2C20H23 |
A2B2C2D20E23 |
-45.57 |
5.02 |
0.0 |
0.0 |
1 |
|
|
165913 |
74613207 |
1 |
N4O4C11H21 |
A4B4C11D21 |
-174.76 |
3.89 |
0.0 |
0.0 |
1 |
|
|
165914 |
74613331 |
1 |
F2N2O3C23H27 |
A2B2C3D23E27 |
-165.92 |
4.98 |
0.0 |
0.0 |
0 |
|
|
165915 |
74614490 |
1 |
SF2N4O4C23H24 |
AB2C4D4E23F24 |
-206.11 |
2.08 |
-8.46 |
-1.12 |
0 |
|
|
165916 |
74614491 |
1 |
F2S2N3O5C19H21 |
A2B2C3D5E19F21 |
-239.54 |
3.98 |
-9.16 |
-1.05 |
0 |
|
|
165917 |
74614492 |
1 |
SF2N3O5C23H25 |
AB2C3D5E23F25 |
-240.82 |
4.99 |
-8.87 |
-1.19 |
0 |
|
|
165918 |
74614493 |
1 |
SF2N4O6C20H20 |
AB2C4D6E20F20 |
-215.28 |
2.14 |
-9.47 |
-1.65 |
0 |
|
|
165919 |
74614559 |
1 |
FN3O3C20H26 |
AB3C3D20E26 |
-134.48 |
5.2 |
-8.87 |
-0.72 |
0 |
|
|
165920 |
74614560 |
1 |
SO4N5C22H29 |
AB4C5D22E29 |
-105.06 |
13.72 |
-9.34 |
-0.96 |
0 |
|
|
165921 |
74614561 |
1 |
OS3N5H15C17 |
AB3C5D15E17 |
103.81 |
5.45 |
-8.51 |
-1.25 |
0 |
|
|
165922 |
74614619 |
1 |
N3O4H23C24 |
A3B4C23D24 |
-82.04 |
1.84 |
-8.92 |
-0.67 |
0 |
|
|
165923 |
74614620 |
1 |
N3O4C24H27 |
A3B4C24D27 |
-91.97 |
6.23 |
-9.56 |
-1.5 |
0 |
|
|
165924 |
74614621 |
1 |
ClN2O4H15C19 |
AB2C4D15E19 |
-40.35 |
4.75 |
-9.25 |
-1.11 |
0 |
|
|
165925 |
74614918 |
1 |
ClNSO7C23H26 |
ABCD7E23F26 |
-236.34 |
8.12 |
-8.82 |
-1.45 |
0 |
|
|
165926 |
74615127 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-85.24 |
5.16 |
-8.07 |
-1.76 |
0 |
|
|
165927 |
74615128 |
1 |
BrN3O4C20H20 |
AB3C4D20E20 |
-52.51 |
4.57 |
-9.16 |
-1.64 |
0 |
|
|
165928 |
74615129 |
1 |
IN3O3H18C19 |
AB3C3D18E19 |
-3.64 |
3.87 |
-9.47 |
-1.5 |
0 |
|
|
165929 |
74615130 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-39.13 |
4.75 |
-9.27 |
-1.75 |
0 |
|
|
165930 |
74616190 |
1 |
N3O4C24H33 |
A3B4C24D33 |
-132.19 |
4.55 |
-8.81 |
-0.4 |
0 |
|
|
165931 |
74616327 |
1 |
N2O5C28H36 |
A2B5C28D36 |
-198.15 |
3.8 |
-8.69 |
-0.55 |
0 |
|
|
165932 |
74616328 |
1 |
ClN2O5C21H21 |
AB2C5D21E21 |
-170.48 |
3.61 |
-9.33 |
-0.51 |
0 |
|
|
165933 |
74616332 |
1 |
ClSO2N3C21H22 |
ABC2D3E21F22 |
19.51 |
6.04 |
-8.8 |
-0.77 |
0 |
|
|
165934 |
74616504 |
1 |
ClN2O6C21H21 |
AB2C6D21E21 |
-203.83 |
6.13 |
-8.91 |
-0.54 |
-1 |
|
|
165935 |
74616804 |
1 |
FN3O5C27H27 |
AB3C5D27E27 |
-135.86 |
10.49 |
0.0 |
0.0 |
0 |
|
|
165936 |
74616843 |
1 |
N3O4C25H27 |
A3B4C25D27 |
-42.59 |
17.81 |
-7.83 |
-1.13 |
0 |
|
|
165937 |
74616844 |
1 |
N2O5H28C30 |
A2B5C28D30 |
-55.68 |
18.15 |
-8.04 |
-1.17 |
0 |
|
|
165938 |
74617111 |
1 |
FN2O4C19H23 |
AB2C4D19E23 |
-168.7 |
3.81 |
-8.97 |
-0.64 |
0 |
|
|
165939 |
74617267 |
1 |
N2O9H22C23 |
A2B9C22D23 |
-218.76 |
4.85 |
-8.3 |
-1.49 |
0 |
|
|
165940 |
74617497 |
1 |
NO7H17C19 |
AB7C17D19 |
-154.3 |
5.27 |
-9.87 |
-1.27 |
0 |
|
|
165941 |
74617751 |
1 |
SN3O5C24H25 |
AB3C5D24E25 |
-111.02 |
7.91 |
-8.64 |
-1.04 |
0 |