List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
131808 |
51263381 |
1 |
ClFSN2O3H10C13 |
ABCD2E3F10G13 |
-121.99 |
3.43 |
-9.24 |
-1.32 |
0 |
|
|
131809 |
51263593 |
1 |
O2N6C17H18 |
A2B6C17D18 |
88.18 |
4.13 |
-8.76 |
-1.06 |
0 |
|
|
131810 |
51263933 |
1 |
SO2N6C17H20 |
AB2C6D17E20 |
60.14 |
6.36 |
-9.03 |
-0.57 |
0 |
|
|
131811 |
51264103 |
1 |
OS2N4H14C15 |
AB2C4D14E15 |
36.52 |
7.5 |
-8.86 |
-1.02 |
0 |
|
|
131812 |
51264234 |
1 |
OS2N4C16H22 |
AB2C4D16E22 |
-21.67 |
2.7 |
-8.72 |
-0.88 |
0 |
|
|
131813 |
51264511 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-91.7 |
6.76 |
-9.2 |
0.24 |
0 |
|
|
131814 |
51264512 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-76.83 |
4.04 |
-9.17 |
-0.38 |
0 |
|
|
131815 |
51264513 |
1 |
O4N5C15H17 |
A4B5C15D17 |
3.21 |
5.74 |
-9.42 |
-1.12 |
0 |
|
|
131816 |
51264514 |
1 |
F2N3O3C14H15 |
A2B3C3D14E15 |
-147.36 |
4.97 |
-9.38 |
-0.24 |
0 |
|
|
131817 |
51264534 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-88.96 |
2.49 |
-9.16 |
-0.33 |
0 |
|
|
131818 |
51264812 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-88.8 |
2.33 |
-9.2 |
-0.93 |
0 |
|
|
131819 |
51264813 |
1 |
ClOSN2C16H17 |
ABCD2E16F17 |
-0.42 |
3.11 |
-9.17 |
-1.27 |
0 |
|
|
131820 |
51264814 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-118.81 |
5.34 |
-8.68 |
-0.31 |
0 |
|
|
131821 |
51264815 |
1 |
N2O4C15H20 |
A2B4C15D20 |
-150.03 |
1.99 |
-8.72 |
-0.33 |
0 |
|
|
131822 |
51264816 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-88.46 |
4.29 |
-8.59 |
-0.8 |
0 |
|
|
131823 |
51264817 |
1 |
SN3O4C15H25 |
AB3C4D15E25 |
-151.54 |
4.73 |
-9.5 |
-0.7 |
0 |
|
|
131824 |
51264818 |
1 |
SN3O3C14H25 |
AB3C3D14E25 |
-135.45 |
3.93 |
-9.34 |
-0.09 |
0 |
|
|
131825 |
51264905 |
2 |
ON2C11H13 |
AB2C11D13 |
-43.33 |
8.33 |
-8.69 |
-0.39 |
0 |
|
|
131826 |
51265344 |
1 |
ClNO2C14H18 |
ABC2D14E18 |
-92.37 |
3.07 |
-9.02 |
-0.31 |
0 |
|
|
131827 |
51265631 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-93.71 |
3.79 |
-9.01 |
-0.22 |
0 |
|
|
131828 |
51265667 |
1 |
NSO5C19H21 |
ABC5D19E21 |
-144.03 |
7.98 |
-8.98 |
-0.77 |
0 |
|
|
131829 |
51265945 |
1 |
N3O4H13C17 |
A3B4C13D17 |
-12.29 |
7.53 |
-9.05 |
-1.53 |
0 |
|
|
131830 |
51266083 |
1 |
SN4O4C15H18 |
AB4C4D15E18 |
-119.99 |
7.43 |
-9.67 |
-0.77 |
0 |
|
|
131831 |
51266564 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-49.84 |
5.53 |
-9.77 |
-1.14 |
0 |
|
|
131832 |
51266565 |
3 |
NOC7H7 |
ABC7D7 |
-91.99 |
6.33 |
-8.08 |
-0.52 |
0 |
|
|
131833 |
51266566 |
1 |
N3O4C22H23 |
A3B4C22D23 |
-128.92 |
2.94 |
-8.2 |
-0.48 |
0 |
|
|
131834 |
51266567 |
1 |
SN4O4C16H28 |
AB4C4D16E28 |
-178.4 |
6.47 |
-9.43 |
-0.47 |
0 |
|
|
131835 |
51266781 |
1 |
N3O4C17H23 |
A3B4C17D23 |
-162.27 |
3.89 |
-8.46 |
-0.05 |
0 |
|
|
131836 |
51267423 |
1 |
FN3O3C15H16 |
AB3C3D15E16 |
-96.56 |
4.36 |
-9.46 |
-0.43 |
0 |
|
|
131837 |
51267621 |
3 |
NOC6H7 |
ABC6D7 |
-60.21 |
6.86 |
-9.34 |
-0.27 |
0 |
|
|
131838 |
51267794 |
1 |
BrO2N3C18H22 |
AB2C3D18E22 |
-26.91 |
3.33 |
-9.11 |
-0.58 |
0 |
|
|
131839 |
51267838 |
1 |
N3O5C19H25 |
A3B5C19D25 |
-146.77 |
7.95 |
-8.8 |
-0.28 |
0 |
|
|
131840 |
51267985 |
1 |
NSO4H17C18 |
ABC4D17E18 |
-98.51 |
4.37 |
-9.31 |
-1.08 |
0 |
|
|
131841 |
51267986 |
1 |
SN2O3C19H20 |
AB2C3D19E20 |
-20.14 |
3.05 |
-9.03 |
-0.61 |
0 |
|
|
131842 |
51268011 |
1 |
NS2O3C17H19 |
AB2C3D17E19 |
-68.3 |
6.05 |
-8.72 |
-0.51 |
0 |
|
|
131843 |
51268012 |
1 |
NSO3C18H19 |
ABC3D18E19 |
-57.29 |
3.79 |
-8.56 |
-0.24 |
0 |
|
|
131844 |
51268013 |
1 |
NSO3C19H23 |
ABC3D19E23 |
-62.55 |
3.31 |
-8.7 |
-0.33 |
0 |
|
|
131845 |
51268418 |
1 |
F3N3O3C19H24 |
A3B3C3D19E24 |
-205.96 |
4.75 |
-9.35 |
-1.32 |
0 |
|
|
131846 |
51268669 |
1 |
SO2N5C20H21 |
AB2C5D20E21 |
37.4 |
3.49 |
-8.64 |
-1.04 |
0 |
|
|
131847 |
51268670 |
1 |
FSO2N4C19H21 |
ABC2D4E19F21 |
-42.87 |
3.85 |
-8.59 |
-0.85 |
0 |
|
|
131848 |
51268671 |
1 |
OSN7C19H19 |
ABC7D19E19 |
117.86 |
3.71 |
-8.54 |
-1.13 |
0 |
|
|
131849 |
51268854 |
1 |
BrFO2N3H13C16 |
ABC2D3E13F16 |
-30.09 |
2.44 |
-9.32 |
-0.98 |
0 |
|
|
131850 |
51268855 |
1 |
FON3C17H20 |
ABC3D17E20 |
-53.77 |
2.24 |
-9.23 |
-0.22 |
0 |
|
|
131851 |
51269007 |
1 |
FON3C16H18 |
ABC3D16E18 |
-28.77 |
1.51 |
-9.15 |
-0.17 |
0 |
|
|
131852 |
51269008 |
1 |
FOCl2N4H13C17 |
ABC2D4E13F17 |
-7.19 |
4.48 |
-9.47 |
-1.19 |
0 |
|
|
131853 |
51269028 |
1 |
FO2N3C23H26 |
AB2C3D23E26 |
-72.45 |
2.47 |
-9.17 |
-0.15 |
0 |
|
|
131854 |
51269057 |
1 |
FO2N3C23H24 |
AB2C3D23E24 |
-66.13 |
3.4 |
-9.15 |
-0.26 |
0 |
|
|
131855 |
51269445 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-49.32 |
9.28 |
-8.92 |
-0.19 |
0 |
|
|
131856 |
51269446 |
1 |
O3N4H20C21 |
A3B4C20D21 |
-3.43 |
9.18 |
-9.21 |
-0.4 |
0 |
|
|
131857 |
51269447 |
1 |
N3O3C23H27 |
A3B3C23D27 |
-67.04 |
4.9 |
-8.52 |
-0.04 |
0 |
|
|
131858 |
51269889 |
1 |
FCl2N2O2H17C18 |
AB2C2D2E17F18 |
-111.06 |
3.32 |
-9.25 |
-0.47 |
0 |
|
|
131859 |
51270053 |
1 |
O3N4H18C21 |
A3B4C18D21 |
-40.84 |
1.63 |
-9.07 |
-1.76 |
0 |
|
|
131860 |
51270132 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-96.26 |
5.71 |
-8.84 |
-0.24 |
0 |
|
|
131861 |
51270415 |
1 |
NSO4C19H19 |
ABC4D19E19 |
-112.74 |
6.86 |
-8.88 |
-0.88 |
0 |
|
|
131862 |
51270416 |
1 |
SN2O2C18H18 |
AB2C2D18E18 |
-23.37 |
3.1 |
-8.63 |
-0.94 |
0 |
|
|
131863 |
51270608 |
1 |
FN3O3C16H16 |
AB3C3D16E16 |
-64.66 |
7.22 |
-9.18 |
-0.99 |
0 |
|
|
131864 |
51270722 |
1 |
N2S2O5C15H18 |
A2B2C5D15E18 |
-145.64 |
10.3 |
-8.59 |
-1.15 |
0 |
|
|
131865 |
51271470 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-98.52 |
5.09 |
-8.95 |
-0.08 |
0 |
|
|
131866 |
51271471 |
1 |
ON4C17H18 |
AB4C17D18 |
81.31 |
3.66 |
-8.41 |
-1.04 |
0 |
|
|
131867 |
51271472 |
1 |
N2O2C19H26 |
A2B2C19D26 |
-53.96 |
4.06 |
-8.49 |
0.36 |
0 |
|
|
131868 |
51271860 |
1 |
ClO2N3C20H20 |
AB2C3D20E20 |
-50.33 |
3.65 |
-9.11 |
-0.82 |
0 |
|
|
131869 |
51271861 |
1 |
SN3O3H17C20 |
AB3C3D17E20 |
-46.83 |
2.8 |
-9.15 |
-0.94 |
0 |
|
|
131870 |
51272251 |
1 |
ClON3C16H20 |
ABC3D16E20 |
-10.6 |
6.26 |
-9.45 |
-0.67 |
0 |
|
|
131871 |
51272562 |
1 |
N4O5H18C19 |
A4B5C18D19 |
-74.21 |
8.95 |
-9.24 |
-1.24 |
0 |
|
|
131872 |
51272563 |
1 |
ClN4O4H15C18 |
AB4C4D15E18 |
-2.55 |
11.59 |
-9.02 |
-1.1 |
0 |
|
|
131873 |
51272985 |
1 |
FON3C18H20 |
ABC3D18E20 |
-33.59 |
2.88 |
-9.31 |
-0.12 |
0 |
|
|
131874 |
51273359 |
1 |
ON3F4H17C20 |
AB3C4D17E20 |
-179.43 |
3.6 |
-9.32 |
-0.64 |
0 |
|
|
131875 |
51273360 |
1 |
FO2N5C21H22 |
AB2C5D21E22 |
-54.1 |
2.53 |
-9.26 |
-0.28 |
0 |
|
|
131876 |
51273484 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-94.74 |
3.14 |
-8.84 |
0.13 |
0 |
|
|
131877 |
51273485 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-98.72 |
3.06 |
-8.83 |
0.11 |
0 |
|
|
131878 |
51273503 |
1 |
N4O4C19H20 |
A4B4C19D20 |
-42.67 |
6.95 |
-9.0 |
-0.85 |
0 |
|
|
131879 |
51273828 |
1 |
SN2O2H20C21 |
AB2C2D20E21 |
11.26 |
5.75 |
-9.02 |
-0.78 |
0 |
|
|
131880 |
51273928 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-88.81 |
3.87 |
-8.47 |
-0.17 |
0 |
|
|
131881 |
51274054 |
1 |
SO3N4C19H24 |
AB3C4D19E24 |
-84.34 |
2.6 |
-8.63 |
-0.66 |
0 |
|
|
131882 |
51274055 |
1 |
SO3N4C19H24 |
AB3C4D19E24 |
-84.54 |
4.88 |
-8.54 |
-0.63 |
0 |
|
|
131883 |
51274056 |
1 |
SO3N4C18H22 |
AB3C4D18E22 |
-76.15 |
2.63 |
-8.67 |
-0.62 |
0 |
|
|
131884 |
51274301 |
1 |
SN2O2C16H24 |
AB2C2D16E24 |
-80.14 |
2.99 |
-8.78 |
-0.27 |
0 |
|
|
131885 |
51274527 |
1 |
OSN2C14H16 |
ABC2D14E16 |
-3.74 |
5.33 |
-8.97 |
-0.39 |
0 |
|
|
131886 |
51274801 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-68.31 |
6.27 |
-9.02 |
-1.29 |
0 |
|
|
131887 |
51274918 |
1 |
FSN4O4H15C17 |
ABC4D4E15F17 |
-37.44 |
9.19 |
-9.58 |
-1.59 |
0 |
|
|
131888 |
51274951 |
1 |
SN2O6C17H20 |
AB2C6D17E20 |
-95.53 |
7.96 |
-9.03 |
-1.52 |
0 |
|
|
131889 |
51274970 |
1 |
SN2O3C18H18 |
AB2C3D18E18 |
-14.12 |
3.43 |
-8.85 |
-1.17 |
0 |
|
|
131890 |
51274971 |
1 |
SN2O3C18H18 |
AB2C3D18E18 |
-14.77 |
7.31 |
-8.99 |
-1.19 |
0 |
|
|
131891 |
51274972 |
1 |
SN2O3C21H26 |
AB2C3D21E26 |
-129.01 |
4.5 |
-8.75 |
-0.42 |
0 |
|
|
131892 |
51275169 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-85.59 |
4.46 |
-9.17 |
-0.2 |
0 |
|
|
131893 |
51275170 |
1 |
O3N4C18H18 |
A3B4C18D18 |
-86.08 |
2.85 |
-9.46 |
-0.91 |
0 |
|
|
131894 |
51275408 |
2 |
NO2C10H10 |
AB2C10D10 |
-102.03 |
0.87 |
-8.99 |
-0.57 |
0 |
|
|
131895 |
51275409 |
1 |
N3O7H15C17 |
A3B7C15D17 |
-128.6 |
8.6 |
-9.17 |
-1.43 |
0 |
|
|
131896 |
51275410 |
1 |
N2O5C18H18 |
A2B5C18D18 |
-132.3 |
0.49 |
-8.88 |
-0.52 |
0 |
|
|
131897 |
51275734 |
1 |
FN2O2C16H17 |
AB2C2D16E17 |
-80.77 |
4.6 |
-8.91 |
-0.42 |
0 |
|
|
131898 |
51276081 |
1 |
SN2O2C20H24 |
AB2C2D20E24 |
-62.24 |
3.14 |
-8.69 |
-0.35 |
0 |
|
|
131899 |
51276162 |
1 |
O2N4C21H22 |
A2B4C21D22 |
-22.89 |
0.91 |
-8.62 |
-0.17 |
0 |
|
|
131900 |
51276312 |
1 |
SN2O5C18H26 |
AB2C5D18E26 |
-190.25 |
7.43 |
-9.21 |
-0.56 |
0 |
|
|
131901 |
51276590 |
1 |
NO4C20H23 |
AB4C20D23 |
-154.09 |
3.55 |
-9.0 |
0.12 |
0 |
|
|
131902 |
51276655 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-43.54 |
3.25 |
-8.93 |
-0.79 |
0 |
|
|
131903 |
51276780 |
1 |
ClN3O3C18H18 |
AB3C3D18E18 |
-82.78 |
6.66 |
-8.36 |
-0.41 |
0 |
|
|
131904 |
51276857 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-144.13 |
1.64 |
-8.84 |
-0.18 |
0 |
|
|
131905 |
51277306 |
1 |
ClNO3H16C17 |
ABC3D16E17 |
-81.45 |
4.72 |
-9.03 |
-0.4 |
0 |
|
|
131906 |
51277476 |
1 |
ClN2S2O3C16H17 |
AB2C2D3E16F17 |
-83.51 |
1.33 |
-9.0 |
-1.11 |
0 |
|
|
131907 |
51277647 |
1 |
SO2N4C15H16 |
AB2C4D15E16 |
-28.94 |
3.11 |
-8.56 |
-0.75 |
0 |