List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
77827 |
49661667 |
1 |
O2N5C27H27 |
A2B5C27D27 |
56.51 |
3.94 |
-8.71 |
-0.77 |
0 |
|
|
77828 |
49661668 |
1 |
ClO2N5H26C27 |
AB2C5D26E27 |
47.67 |
5.42 |
-8.75 |
-0.84 |
0 |
|
|
77829 |
49661670 |
1 |
O2N5C26H31 |
A2B5C26D31 |
11.35 |
3.35 |
-8.67 |
-0.72 |
0 |
|
|
77830 |
49661671 |
1 |
O2N5C27H27 |
A2B5C27D27 |
51.48 |
3.78 |
-8.66 |
-0.71 |
0 |
|
|
77831 |
49661673 |
1 |
O2N5C23H25 |
A2B5C23D25 |
48.98 |
3.33 |
-8.69 |
-0.71 |
0 |
|
|
77832 |
49661674 |
1 |
O2N6H24C25 |
A2B6C24D25 |
69.49 |
2.14 |
-8.78 |
-0.78 |
0 |
|
|
77833 |
49661679 |
1 |
O3N5C24H27 |
A3B5C24D27 |
-15.72 |
4.27 |
-8.66 |
-0.65 |
0 |
|
|
77834 |
49661680 |
1 |
O2N6C25H30 |
A2B6C25D30 |
30.56 |
4.66 |
-8.68 |
-0.7 |
0 |
|
|
77835 |
49661685 |
1 |
O3N5C29H31 |
A3B5C29D31 |
3.24 |
4.91 |
-8.67 |
-0.62 |
0 |
|
|
77836 |
49661689 |
1 |
FO3N5H26C27 |
AB3C5D26E27 |
-24.68 |
7.45 |
-8.71 |
-0.84 |
0 |
|
|
77837 |
49661697 |
1 |
SO3N5H15C17 |
AB3C5D15E17 |
-26.92 |
4.19 |
-9.41 |
-1.68 |
0 |
|
|
77838 |
49661707 |
1 |
FOSN6C19H19 |
ABCD6E19F19 |
23.17 |
6.61 |
-9.35 |
-1.56 |
0 |
|
|
77839 |
49661712 |
1 |
OSF3N5H14C17 |
ABC3D5E14F17 |
-105.2 |
6.33 |
-9.95 |
-1.81 |
0 |
|
|
77840 |
49661729 |
1 |
ClO2N4C20H21 |
AB2C4D20E21 |
2.14 |
2.64 |
-8.48 |
-0.29 |
0 |
|
|
77841 |
49661731 |
1 |
SO3N4C17H18 |
AB3C4D17E18 |
-63.8 |
1.5 |
-8.7 |
-1.64 |
0 |
|
|
77842 |
49661732 |
1 |
SN4O4C17H18 |
AB4C4D17E18 |
-93.82 |
6.7 |
-8.55 |
-1.52 |
0 |
|
|
77843 |
49661740 |
1 |
SN4O5C18H18 |
AB4C5D18E18 |
-141.46 |
5.12 |
-9.19 |
-1.76 |
0 |
|
|
77844 |
49661741 |
1 |
BrSO3N4H15C16 |
ABC3D4E15F16 |
-57.99 |
3.54 |
-8.91 |
-1.38 |
0 |
|
|
77845 |
49661743 |
1 |
SF2O3N4H12C15 |
AB2C3D4E12F15 |
-135.96 |
4.36 |
-9.1 |
-1.61 |
0 |
|
|
77846 |
49661745 |
1 |
ClSO3N4C17H17 |
ABC3D4E17F17 |
-73.98 |
5.47 |
-8.96 |
-1.62 |
0 |
|
|
77847 |
49661751 |
1 |
SO3N4C19H20 |
AB3C4D19E20 |
-51.32 |
1.67 |
-8.62 |
-1.59 |
0 |
|
|
77848 |
49661754 |
1 |
ClSN4O4H17C18 |
ABC4D4E17F18 |
-79.49 |
4.67 |
-8.52 |
-1.7 |
0 |
|
|
77849 |
49661755 |
1 |
SO3N4C18H18 |
AB3C4D18E18 |
-44.19 |
2.11 |
-8.88 |
-1.65 |
0 |
|
|
77850 |
49661758 |
1 |
ClSO3N4H17C18 |
ABC3D4E17F18 |
-48.99 |
6.15 |
-9.04 |
-1.62 |
0 |
|
|
77851 |
49661761 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-51.73 |
5.14 |
-9.06 |
-1.55 |
0 |
|
|
77852 |
49661772 |
1 |
ClSO3N4C23H29 |
ABC3D4E23F29 |
-93.8 |
7.5 |
-8.99 |
-0.56 |
0 |
|
|
77853 |
49661773 |
1 |
ClFSO3N4C23H28 |
ABCD3E4F23G28 |
-142.16 |
3.85 |
-8.91 |
-0.6 |
0 |
|
|
77854 |
49661778 |
1 |
SN4O4C19H30 |
AB4C4D19E30 |
-153.85 |
3.85 |
-8.87 |
-0.58 |
0 |
|
|
77855 |
49661790 |
1 |
SO3N4C23H30 |
AB3C4D23E30 |
-91.82 |
5.93 |
-8.62 |
-0.65 |
0 |
|
|
77856 |
49664947 |
1 |
ClFO2N4H14C18 |
ABC2D4E14F18 |
-60.11 |
5.09 |
-9.13 |
-1.35 |
0 |
|
|
77857 |
49665028 |
1 |
ClFSO2N4H14C19 |
ABCD2E4F14G19 |
2.33 |
6.28 |
-9.39 |
-1.76 |
0 |
|
|
77858 |
49665731 |
1 |
F2O2N5H17C21 |
A2B2C5D17E21 |
-67.23 |
4.34 |
-9.13 |
-1.29 |
0 |
|
|
77859 |
49665783 |
1 |
ON5C21H23 |
AB5C21D23 |
57.88 |
3.42 |
-8.72 |
-1.18 |
0 |
|
|
77860 |
49665790 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-26.99 |
5.64 |
-8.51 |
-1.1 |
0 |
|
|
77861 |
49665805 |
1 |
FON4C19H19 |
ABC4D19E19 |
-9.71 |
3.73 |
-9.0 |
-0.96 |
0 |
|
|
77862 |
49665806 |
1 |
ClON4C19H19 |
ABC4D19E19 |
29.21 |
2.79 |
-9.0 |
-1.06 |
0 |
|
|
77863 |
49665930 |
1 |
ClN4O4H17C21 |
AB4C4D17E21 |
-22.01 |
7.8 |
-8.8 |
-1.13 |
0 |
|
|
77864 |
49665949 |
1 |
ClFSO3N4H16C17 |
ABCD3E4F16G17 |
-90.93 |
4.68 |
-9.18 |
-1.13 |
0 |
|
|
77865 |
49665951 |
1 |
SO3N4C12H16 |
AB3C4D12E16 |
-63.28 |
3.98 |
-9.17 |
-1.14 |
0 |
|
|
77866 |
49665952 |
1 |
SO3N4C15H22 |
AB3C4D15E22 |
-82.22 |
3.74 |
-9.07 |
-1.07 |
0 |
|
|
77867 |
49665992 |
1 |
FSO3N4C19H21 |
ABC3D4E19F21 |
-95.94 |
4.22 |
-9.21 |
-1.16 |
0 |
|
|
77868 |
49665993 |
1 |
FSO3N4C19H21 |
ABC3D4E19F21 |
-92.51 |
3.69 |
-9.2 |
-1.16 |
0 |
|
|
77869 |
49665994 |
1 |
SF2O3N4C19H20 |
AB2C3D4E19F20 |
-143.57 |
3.77 |
-9.29 |
-1.24 |
0 |
|
|
77870 |
49666006 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-59.15 |
6.57 |
-9.02 |
-1.02 |
0 |
|
|
77871 |
49666064 |
1 |
ClSO2N4H15C19 |
ABC2D4E15F19 |
48.17 |
4.31 |
-9.66 |
-1.57 |
0 |
|
|
77872 |
49666065 |
1 |
ClSO2N4H15C19 |
ABC2D4E15F19 |
48.37 |
5.65 |
-9.67 |
-1.58 |
0 |
|
|
77873 |
49666067 |
1 |
SF2O2N4H16C20 |
AB2C2D4E16F20 |
-46.84 |
3.98 |
-9.6 |
-1.53 |
0 |
|
|
77874 |
49666068 |
1 |
SO2N4H20C21 |
AB2C4D20E21 |
41.76 |
4.98 |
-9.55 |
-1.37 |
0 |
|
|
77875 |
49666152 |
1 |
FSO2N4H19C21 |
ABC2D4E19F21 |
-8.99 |
3.48 |
-9.41 |
-1.49 |
0 |
|
|
77876 |
49666153 |
1 |
FSO2N4H19C22 |
ABC2D4E19F22 |
10.98 |
2.89 |
-9.19 |
-1.46 |
0 |
|
|
77877 |
49666154 |
1 |
FSO3N4H19C21 |
ABC3D4E19F21 |
-40.03 |
4.96 |
-9.1 |
-1.46 |
0 |
|
|
77878 |
49666155 |
1 |
SF2O2N4H16C20 |
AB2C2D4E16F20 |
-47.57 |
5.85 |
-9.38 |
-1.43 |
0 |
|
|
77879 |
49666283 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-132.0 |
4.52 |
-8.77 |
-1.35 |
0 |
|
|
77880 |
49666284 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-133.33 |
4.29 |
-8.95 |
-1.31 |
0 |
|
|
77881 |
49666380 |
1 |
SN3O5C22H27 |
AB3C5D22E27 |
-172.98 |
6.1 |
-8.76 |
-1.26 |
0 |
|
|
77882 |
49666400 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-139.94 |
4.49 |
-9.2 |
-1.24 |
0 |
|
|
77883 |
49666401 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-181.9 |
3.44 |
-9.28 |
-1.07 |
0 |
|
|
77884 |
49666402 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-188.78 |
3.59 |
-9.35 |
-1.19 |
0 |
|
|
77885 |
49666408 |
1 |
SN3O6C21H25 |
AB3C6D21E25 |
-196.16 |
5.72 |
-8.75 |
-1.18 |
0 |
|
|
77886 |
49666409 |
1 |
FSN3O4C20H24 |
ABC3D4E20F24 |
-180.06 |
6.82 |
-9.07 |
-1.2 |
0 |
|
|
77887 |
49666410 |
1 |
ClSN3O4C20H24 |
ABC3D4E20F24 |
-147.99 |
4.47 |
-9.21 |
-0.98 |
0 |
|
|
77888 |
49666418 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-154.05 |
4.42 |
-8.88 |
-1.26 |
0 |
|
|
77889 |
49666419 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-138.99 |
6.24 |
-8.75 |
-1.29 |
0 |
|
|
77890 |
49666420 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-142.87 |
4.23 |
-9.04 |
-1.29 |
0 |
|
|
77891 |
49666423 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-143.66 |
6.12 |
-8.68 |
-1.3 |
0 |
|
|
77892 |
49666458 |
1 |
SN3O4C16H25 |
AB3C4D16E25 |
-172.93 |
3.67 |
-9.37 |
-1.25 |
0 |
|
|
77893 |
49666466 |
1 |
FSN3O4C20H24 |
ABC3D4E20F24 |
-181.63 |
3.82 |
-9.24 |
-1.25 |
0 |
|
|
77894 |
49666477 |
1 |
SN3O5C20H25 |
AB3C5D20E25 |
-177.95 |
4.54 |
-8.84 |
-1.45 |
0 |
|
|
77895 |
49666478 |
1 |
SN3O5C18H21 |
AB3C5D18E21 |
-155.45 |
8.99 |
-9.02 |
-1.01 |
0 |
|
|
77896 |
49666507 |
1 |
SO3N5H15C16 |
AB3C5D15E16 |
-49.69 |
5.15 |
-8.78 |
-1.94 |
0 |
|
|
77897 |
49666508 |
1 |
FSO3N6H17C18 |
ABC3D6E17F18 |
-68.77 |
7.59 |
-9.26 |
-1.63 |
0 |
|
|
77898 |
49666532 |
1 |
FSN2O3H9C14 |
ABC2D3E9F14 |
-122.77 |
3.04 |
-8.98 |
-1.2 |
0 |
|
|
77899 |
49666535 |
1 |
SN2O5H16C17 |
AB2C5D16E17 |
-150.6 |
1.29 |
-8.41 |
-0.95 |
0 |
|
|
77900 |
49666546 |
1 |
SN2O3H14C16 |
AB2C3D14E16 |
-84.94 |
1.14 |
-8.68 |
-0.96 |
0 |
|
|
77901 |
49666547 |
1 |
ClSN2O3H11C15 |
ABC2D3E11F15 |
-82.46 |
2.45 |
-8.74 |
-1.05 |
0 |