List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
308036 |
125312376 |
1 |
ClNOF3H11C15 |
ABCD3E11F15 |
-117.16 |
3.68 |
-9.23 |
-0.86 |
0 |
|
|
308037 |
125312377 |
1 |
ClNOF3H11C15 |
ABCD3E11F15 |
-105.15 |
3.56 |
-9.23 |
-0.86 |
0 |
|
|
308038 |
125312378 |
1 |
ClO9C26H45 |
AB9C26D45 |
-482.48 |
9.53 |
-10.37 |
-0.26 |
0 |
|
|
308039 |
125312383 |
1 |
ON3H5C7 |
AB3C5D7 |
70.66 |
9.0 |
-10.08 |
-2.64 |
0 |
|
|
308040 |
125312397 |
1 |
BrClO2N5H17C18 |
ABC2D5E17F18 |
28.74 |
2.59 |
-9.08 |
-1.74 |
0 |
|
|
308041 |
125312536 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-44.85 |
3.97 |
-8.98 |
-0.62 |
0 |
|
|
308042 |
125312556 |
1 |
FN2O5H19C24 |
AB2C5D19E24 |
-113.2 |
4.04 |
-8.88 |
-1.36 |
0 |
|
|
308043 |
125312609 |
1 |
O2N3H17C21 |
A2B3C17D21 |
19.24 |
4.71 |
-8.78 |
-1.03 |
0 |
|
|
308044 |
125312623 |
1 |
N2O3F4H18C24 |
A2B3C4D18E24 |
-193.73 |
6.79 |
-9.11 |
-1.31 |
0 |
|
|
308045 |
125312629 |
1 |
N3O5C23H23 |
A3B5C23D23 |
-69.88 |
9.18 |
-9.25 |
-1.47 |
0 |
|
|
308046 |
125312634 |
1 |
NOC23H31 |
ABC23D31 |
-24.46 |
2.65 |
-8.62 |
0.44 |
0 |
|
|
308047 |
125312840 |
1 |
NO3C20H27 |
AB3C20D27 |
-142.09 |
1.75 |
-9.46 |
0.16 |
0 |
|
|
308048 |
125312842 |
1 |
NO3C20H27 |
AB3C20D27 |
-140.81 |
1.63 |
-9.55 |
0.09 |
0 |
|
|
308051 |
125316755 |
1 |
SO2N4C13H16 |
AB2C4D13E16 |
-6.61 |
4.74 |
-8.5 |
-1.02 |
0 |
|
|
308052 |
125316757 |
1 |
BrON4H9C11 |
ABC4D9E11 |
75.66 |
3.82 |
-9.52 |
-1.43 |
0 |
|
|
308053 |
125316760 |
1 |
N3O5H29C30 |
A3B5C29D30 |
-71.61 |
3.55 |
-8.18 |
-1.07 |
0 |
|
|
308054 |
125316761 |
1 |
N3O5H29C30 |
A3B5C29D30 |
-74.25 |
3.2 |
-8.32 |
-1.22 |
0 |
|
|
308056 |
125316765 |
1 |
ClN3O3H14C20 |
AB3C3D14E20 |
-19.97 |
4.04 |
-9.24 |
-1.0 |
0 |
|
|
308057 |
125316766 |
1 |
ClN2O2S2H9C13 |
AB2C2D2E9F13 |
26.99 |
3.95 |
-9.44 |
-2.26 |
0 |
|
|
308058 |
125316769 |
1 |
OS3N4C13H14 |
AB3C4D13E14 |
87.37 |
3.46 |
-8.82 |
-2.77 |
0 |
|
|
308059 |
125316779 |
1 |
N3O3C26H29 |
A3B3C26D29 |
-54.16 |
2.92 |
-9.03 |
-1.12 |
0 |
|
|
308062 |
125316803 |
1 |
Cl2N2O2C23H32 |
A2B2C2D23E32 |
-91.93 |
2.21 |
-8.63 |
-0.04 |
0 |
|
|
308063 |
125316804 |
1 |
Cl2N2O2C23H32 |
A2B2C2D23E32 |
-91.62 |
3.76 |
-8.57 |
0.01 |
0 |
|
|
308064 |
125316805 |
1 |
N3H11C13 |
A3B11C13 |
105.01 |
4.34 |
-9.05 |
-1.12 |
0 |
|
|
308065 |
125316810 |
1 |
NF3O5H12C17 |
AB3C5D12E17 |
-278.85 |
2.91 |
-10.52 |
-1.73 |
0 |
|
|
308066 |
125316823 |
1 |
N2O5H26C27 |
A2B5C26D27 |
-86.02 |
5.52 |
-8.74 |
-0.94 |
0 |
|
|
308068 |
125316833 |
1 |
O2N4C15H16 |
A2B4C15D16 |
40.19 |
2.2 |
-9.32 |
-1.21 |
0 |
|
|
308069 |
125316834 |
1 |
ClN2O3C15H15 |
AB2C3D15E15 |
-70.91 |
6.0 |
-9.31 |
-1.42 |
0 |
|
|
308070 |
125316835 |
1 |
ClN2O3C15H15 |
AB2C3D15E15 |
-70.51 |
8.0 |
-9.41 |
-1.51 |
-1 |
|
|
308071 |
125316838 |
1 |
OC9H11 |
AB9C11 |
16.8 |
2.14 |
0.0 |
0.0 |
0 |
|
|
308072 |
125316840 |
1 |
ClSN3O3C20H20 |
ABC3D3E20F20 |
-72.77 |
5.68 |
-9.76 |
-1.66 |
0 |
|
|
308074 |
125316853 |
1 |
NO8H19C24 |
AB8C19D24 |
-232.73 |
5.37 |
-9.1 |
-1.59 |
0 |
|
|
308075 |
125316855 |
1 |
N4O5C23H24 |
A4B5C23D24 |
-172.68 |
3.84 |
-9.43 |
-0.81 |
0 |
|
|
308076 |
125316856 |
1 |
N4O5C23H24 |
A4B5C23D24 |
-173.33 |
8.45 |
-9.31 |
-0.75 |
0 |
|
|
308079 |
125316874 |
1 |
N2O4H28C31 |
A2B4C28D31 |
-67.37 |
1.32 |
-8.17 |
-0.87 |
0 |
|
|
308080 |
125316877 |
1 |
NO7C27H37 |
AB7C27D37 |
-257.1 |
2.86 |
-9.67 |
-0.82 |
0 |
|
|
308081 |
125316878 |
1 |
NO7C27H37 |
AB7C27D37 |
-307.05 |
2.23 |
-9.69 |
-0.83 |
0 |
|
|
308082 |
125316882 |
1 |
ClN2O2C17H19 |
AB2C2D17E19 |
-36.41 |
5.9 |
-9.64 |
-0.53 |
0 |
|
|
308083 |
125316885 |
1 |
ClIN2H4C7 |
ABC2D4E7 |
79.63 |
4.57 |
-9.65 |
-1.3 |
0 |
|
|
308084 |
125316887 |
1 |
NO4C29H37 |
AB4C29D37 |
-141.47 |
4.89 |
-8.41 |
-0.22 |
0 |
|
|
308085 |
125316892 |
2 |
O2N3H9C10 |
A2B3C9D10 |
38.22 |
13.54 |
-9.68 |
-1.94 |
0 |
|
|
308086 |
125316893 |
1 |
SO2N4H18C19 |
AB2C4D18E19 |
18.51 |
2.43 |
-8.86 |
-0.97 |
0 |
|
|
308087 |
125316898 |
1 |
NO3H9C11 |
AB3C9D11 |
-89.46 |
5.94 |
-10.15 |
-1.48 |
0 |
|
|
308088 |
125316908 |
1 |
FON3H10C12 |
ABC3D10E12 |
-9.33 |
4.47 |
-10.02 |
-1.62 |
0 |
|
|
308089 |
125316910 |
2 |
ON2C11H12 |
AB2C11D12 |
-33.53 |
9.41 |
-7.77 |
-0.6 |
0 |
|
|
308092 |
125316915 |
1 |
N3O4H25C26 |
A3B4C25D26 |
-34.02 |
7.55 |
-8.57 |
-0.84 |
0 |
|
|
308093 |
125316916 |
1 |
O2N4H12C13 |
A2B4C12D13 |
20.28 |
4.04 |
-9.31 |
-0.7 |
0 |
|
|
308094 |
125316917 |
1 |
N3O4H25C26 |
A3B4C25D26 |
-36.18 |
6.52 |
-8.51 |
-0.91 |
0 |
|
|
308095 |
125316918 |
1 |
N3O4H25C26 |
A3B4C25D26 |
-20.62 |
7.34 |
-8.64 |
-0.76 |
0 |
|
|
308100 |
125316934 |
1 |
N5O5C17H19 |
A5B5C17D19 |
-95.26 |
4.47 |
-9.76 |
-2.31 |
0 |