List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
323867 |
126676378 |
1 |
ON7C17H23 |
AB7C17D23 |
59.68 |
4.14 |
-8.28 |
0.17 |
0 |
|
|
323868 |
126676380 |
1 |
FN3O3C19H20 |
AB3C3D19E20 |
-122.91 |
1.4 |
-9.54 |
-1.18 |
0 |
|
|
323869 |
126676382 |
1 |
N3O5C19H19 |
A3B5C19D19 |
-149.6 |
4.98 |
-9.75 |
-1.38 |
0 |
|
|
323870 |
126676383 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-44.16 |
4.41 |
-9.18 |
-0.82 |
0 |
|
|
323871 |
126676385 |
2 |
NO2C9H9 |
AB2C9D9 |
-111.18 |
8.89 |
-9.45 |
-1.05 |
0 |
|
|
323872 |
126676389 |
1 |
OC18H20 |
AB18C20 |
-15.04 |
1.59 |
-8.73 |
0.27 |
0 |
|
|
323873 |
126676391 |
1 |
NO2C13H19 |
AB2C13D19 |
-80.79 |
1.26 |
-8.86 |
0.32 |
0 |
|
|
323874 |
126676398 |
1 |
NOC11H11 |
ABC11D11 |
32.52 |
3.5 |
-9.25 |
-0.42 |
0 |
|
|
323875 |
126676400 |
1 |
N3O7C13H27 |
A3B7C13D27 |
-324.48 |
2.81 |
-9.8 |
0.7 |
0 |
|
|
323876 |
126676411 |
1 |
O3N4H16C17 |
A3B4C16D17 |
-70.68 |
4.26 |
-8.85 |
-1.02 |
0 |
|
|
323877 |
126676412 |
1 |
SN2O2C26H36 |
AB2C2D26E36 |
-1.32 |
4.1 |
-7.25 |
0.04 |
0 |
|
|
323878 |
126676421 |
1 |
N3O7C17H35 |
A3B7C17D35 |
-345.69 |
1.83 |
-9.24 |
0.67 |
0 |
|
|
323879 |
126676422 |
1 |
N9C23H29 |
A9B23C29 |
144.37 |
1.68 |
-8.37 |
-0.67 |
0 |
|
|
323880 |
126676423 |
1 |
N8C23H32 |
A8B23C32 |
85.42 |
1.31 |
-8.09 |
0.25 |
0 |
|
|
323881 |
126676425 |
2 |
N4C9H10 |
A4B9C10 |
156.48 |
6.89 |
-8.94 |
-0.81 |
0 |
|
|
323882 |
126676429 |
1 |
N7C26H35 |
A7B26C35 |
122.86 |
4.19 |
-8.22 |
-0.42 |
0 |
|
|
323883 |
126676434 |
2 |
FON3H14C15 |
ABC3D14E15 |
-50.35 |
7.3 |
-9.43 |
-1.21 |
0 |
|
|
323884 |
126676437 |
1 |
N7C19H19 |
A7B19C19 |
146.59 |
2.56 |
-9.06 |
-0.95 |
0 |
|
|
323885 |
126676438 |
1 |
N2F3O5C23H35 |
A2B3C5D23E35 |
-434.4 |
7.91 |
-9.08 |
0.19 |
0 |
|
|
323886 |
126676443 |
1 |
N2O3C16H16 |
A2B3C16D16 |
-70.08 |
4.75 |
-8.4 |
-0.5 |
0 |
|
|
323887 |
126676444 |
1 |
BrN5H38C44 |
AB5C38D44 |
222.57 |
3.86 |
-8.1 |
-0.75 |
0 |
|
|
323888 |
126676456 |
1 |
SCl2N8H22C26 |
AB2C8D22E26 |
162.87 |
3.89 |
-8.55 |
-1.21 |
0 |
|
|
323889 |
126676461 |
1 |
OCl2H10C13 |
AB2C10D13 |
-25.61 |
3.01 |
-8.88 |
-0.41 |
0 |
|
|
323890 |
126676463 |
1 |
F2O4N5H27C28 |
A2B4C5D27E28 |
-161.01 |
7.45 |
-8.72 |
-1.31 |
0 |
|
|
323892 |
126676465 |
1 |
N9C17H19 |
A9B17C19 |
151.11 |
5.82 |
-8.38 |
-0.71 |
0 |
|
|
323893 |
126676466 |
1 |
F2O3N6H26C27 |
A2B3C6D26E27 |
-77.15 |
5.15 |
-9.04 |
-1.43 |
0 |
|
|
323894 |
126676468 |
1 |
NO4C23H29 |
AB4C23D29 |
-160.87 |
1.5 |
-9.06 |
-0.17 |
0 |
|
|
323895 |
126676472 |
1 |
F2N4O5H28C30 |
A2B4C5D28E30 |
-188.24 |
5.62 |
-9.75 |
-1.53 |
0 |
|
|
323896 |
126676473 |
1 |
ClNOH10C11 |
ABCD10E11 |
-7.56 |
1.91 |
-8.82 |
-0.93 |
0 |
|
|
323897 |
126676474 |
1 |
SF2N3O7C29H29 |
AB2C3D7E29F29 |
-279.17 |
6.09 |
-9.04 |
-1.39 |
0 |
|
|
323898 |
126676475 |
1 |
N8C17H20 |
A8B17C20 |
138.33 |
3.69 |
-8.28 |
-0.13 |
0 |
|
|
323899 |
126676478 |
1 |
ClFNO2H13C16 |
ABCD2E13F16 |
-77.35 |
6.58 |
-9.32 |
-0.95 |
0 |
|
|
323900 |
126676489 |
1 |
N5H15C16 |
A5B15C16 |
194.37 |
3.4 |
-8.78 |
-0.92 |
0 |
|
|
323901 |
126676492 |
1 |
ClN7C12H12 |
AB7C12D12 |
106.09 |
2.27 |
-8.33 |
-1.04 |
0 |
|
|
323902 |
126676503 |
1 |
N4C9H18 |
A4B9C18 |
32.93 |
2.1 |
-7.82 |
0.56 |
0 |
|
|
323903 |
126676504 |
1 |
ClSO2N3C13H16 |
ABC2D3E13F16 |
-20.02 |
2.65 |
-8.87 |
-0.3 |
0 |
|
|
323905 |
126676513 |
1 |
ON7C26H31 |
AB7C26D31 |
72.82 |
1.79 |
-8.25 |
0.16 |
0 |
|
|
323906 |
126676516 |
1 |
ON7C20H25 |
AB7C20D25 |
49.05 |
4.68 |
-8.2 |
-0.21 |
0 |
|
|
323907 |
126676540 |
1 |
F3N8C22H25 |
A3B8C22D25 |
-37.17 |
3.86 |
-8.3 |
-0.33 |
0 |
|
|
323908 |
126676542 |
1 |
F3N8C22H29 |
A3B8C22D29 |
-72.62 |
5.59 |
-8.52 |
-0.14 |
0 |
|
|
323909 |
126676561 |
1 |
N5C15H23 |
A5B15C23 |
59.83 |
3.95 |
-8.98 |
-0.82 |
0 |
|
|
323910 |
126676566 |
1 |
ON3C16H25 |
AB3C16D25 |
-36.08 |
4.29 |
-8.56 |
0.3 |
0 |
|
|
323911 |
126676576 |
1 |
ClF2N3O3C22H24 |
AB2C3D3E22F24 |
-166.8 |
2.36 |
-9.01 |
-1.12 |
0 |
|
|
323912 |
126676577 |
1 |
ON3C14H15 |
AB3C14D15 |
13.25 |
5.48 |
-9.81 |
-0.65 |
0 |
|
|
323913 |
126676581 |
1 |
ClN7H14C15 |
AB7C14D15 |
133.86 |
3.21 |
-8.37 |
-0.91 |
0 |
|
|
323914 |
126676585 |
1 |
ClSN4O4C14H17 |
ABC4D4E14F17 |
-97.01 |
4.6 |
-8.92 |
-0.37 |
0 |
|
|
323915 |
126676589 |
1 |
OF2N7H15C17 |
AB2C7D15E17 |
10.68 |
4.03 |
-9.0 |
-0.87 |
0 |
|
|
323916 |
126676593 |
1 |
OF2N7C17H17 |
AB2C7D17E17 |
-8.55 |
2.15 |
-8.37 |
-0.64 |
0 |
|
|
323917 |
126676594 |
1 |
ClO2F4N4H17C22 |
AB2C4D4E17F22 |
-175.88 |
1.94 |
-9.1 |
-1.05 |
0 |
|
|
323918 |
126676596 |
1 |
ON8C24H26 |
AB8C24D26 |
131.63 |
7.39 |
-8.73 |
-0.8 |
0 |
|
|
323919 |
126676597 |
1 |
ON8C24H30 |
AB8C24D30 |
82.88 |
4.64 |
-8.26 |
-0.58 |
0 |
|
|
323920 |
126676598 |
1 |
O2N7C17H19 |
A2B7C17D19 |
30.22 |
4.64 |
-8.47 |
-1.13 |
0 |
|
|
323921 |
126676608 |
1 |
O2C11H24 |
A2B11C24 |
-133.18 |
2.27 |
-9.73 |
1.98 |
0 |
|
|
323922 |
126676609 |
1 |
N4O10C21H42 |
A4B10C21D42 |
-477.17 |
3.51 |
-9.29 |
0.73 |
0 |
|
|
323923 |
126676610 |
1 |
N7C18H19 |
A7B18C19 |
154.72 |
1.7 |
-8.36 |
-0.46 |
0 |
|
|
323924 |
126676621 |
1 |
N7C22H23 |
A7B22C23 |
134.87 |
5.38 |
-8.36 |
-0.4 |
0 |
|
|
323925 |
126676626 |
1 |
F2N3O3C23H23 |
A2B3C3D23E23 |
-136.75 |
4.78 |
-8.51 |
-0.61 |
0 |
|
|
323926 |
126676627 |
1 |
ClO2N3C25H26 |
AB2C3D25E26 |
-0.92 |
1.49 |
-8.81 |
-0.72 |
0 |
|
|
323927 |
126676629 |
1 |
Cl2O2N3H21C23 |
A2B2C3D21E23 |
1.34 |
1.82 |
-8.7 |
-0.72 |
0 |
|
|
323928 |
126676630 |
1 |
NO3C18H27 |
AB3C18D27 |
-156.87 |
1.97 |
-9.41 |
0.1 |
0 |
|
|
323929 |
126676631 |
1 |
SN3O5C12H17 |
AB3C5D12E17 |
-147.59 |
3.77 |
-9.25 |
-0.46 |
0 |
|
|
323930 |
126676632 |
1 |
ClN8C12H13 |
AB8C12D13 |
124.55 |
3.51 |
-8.54 |
-1.22 |
0 |
|
|
323931 |
126676633 |
1 |
F3N7H14C17 |
A3B7C14D17 |
-5.62 |
5.67 |
-9.02 |
-1.05 |
0 |
|
|
323932 |
126676636 |
1 |
N6O9C17H36 |
A6B9C17D36 |
-391.75 |
7.96 |
-9.14 |
0.28 |
0 |
|
|
323933 |
126676637 |
1 |
N6O10C17H34 |
A6B10C17D34 |
-443.01 |
5.4 |
-9.4 |
0.63 |
0 |
|
|
323934 |
126676638 |
1 |
ON10C21H26 |
AB10C21D26 |
98.23 |
3.79 |
-8.29 |
-0.3 |
0 |
|
|
323935 |
126676639 |
1 |
OSN6C22H28 |
ABC6D22E28 |
69.08 |
6.0 |
-8.4 |
-0.38 |
0 |
|
|
323936 |
126676640 |
1 |
N7H21C24 |
A7B21C24 |
126.03 |
5.4 |
-8.16 |
-0.77 |
0 |
|
|
323937 |
126676641 |
1 |
N8H20C23 |
A8B20C23 |
137.84 |
4.51 |
-8.36 |
-0.73 |
0 |
|
|
323938 |
126676642 |
2 |
N3H10C12 |
A3B10C12 |
133.04 |
5.56 |
-8.21 |
-0.64 |
0 |
|
|
323939 |
126676643 |
1 |
N7H23C25 |
A7B23C25 |
139.17 |
4.59 |
-8.21 |
-0.63 |
0 |
|
|
323940 |
126676645 |
1 |
N6H22C31 |
A6B22C31 |
178.12 |
3.42 |
-8.32 |
-1.06 |
0 |
|
|
323941 |
126676647 |
2 |
ON4C9H12 |
AB4C9D12 |
17.03 |
5.52 |
-9.03 |
-0.88 |
0 |
|
|
323942 |
126676648 |
1 |
O2C15H16 |
A2B15C16 |
-24.81 |
1.51 |
-8.95 |
-0.28 |
0 |
|
|
323943 |
126676649 |
2 |
ON4C9H14 |
AB4C9D14 |
-30.52 |
3.86 |
-8.33 |
0.23 |
0 |