List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
426810 |
135153999 |
1 |
O3N8C21H26 |
A3B8C21D26 |
15.62 |
9.2 |
-8.87 |
-1.16 |
0 |
|
|
426811 |
135154000 |
1 |
N4O4C19H22 |
A4B4C19D22 |
-61.98 |
2.68 |
-8.78 |
-1.08 |
0 |
|
|
426812 |
135154002 |
1 |
ClN2O4C21H23 |
AB2C4D21E23 |
-122.77 |
2.74 |
-8.96 |
-0.91 |
0 |
|
|
426813 |
135154003 |
1 |
ClNSO3H18C22 |
ABCD3E18F22 |
-34.42 |
3.05 |
-9.08 |
-0.76 |
0 |
|
|
426814 |
135154006 |
1 |
SO2N5C17H19 |
AB2C5D17E19 |
21.18 |
3.72 |
-8.82 |
-1.17 |
0 |
|
|
426815 |
135154008 |
1 |
O2N6C25H26 |
A2B6C25D26 |
36.06 |
6.71 |
-8.39 |
-0.92 |
0 |
|
|
426816 |
135154009 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-19.66 |
3.45 |
-8.6 |
-0.29 |
0 |
|
|
426817 |
135154040 |
1 |
F3O4N5C27H32 |
A3B4C5D27E32 |
-284.53 |
4.59 |
-8.99 |
-0.28 |
0 |
|
|
426818 |
135154044 |
2 |
ON3C12H12 |
AB3C12D12 |
50.82 |
6.57 |
-9.19 |
-1.09 |
0 |
|
|
426819 |
135154059 |
1 |
O3N6C22H24 |
A3B6C22D24 |
-6.46 |
6.81 |
-8.86 |
-1.19 |
0 |
|
|
426820 |
135154063 |
1 |
O3N7C22H27 |
A3B7C22D27 |
-9.45 |
8.92 |
-8.87 |
-1.13 |
0 |
|
|
426821 |
135154064 |
1 |
OCl2N2C6H6 |
AB2C2D6E6 |
-24.25 |
3.33 |
-10.36 |
-1.21 |
0 |
|
|
426822 |
135154079 |
1 |
ClO2N4C16H19 |
AB2C4D16E19 |
-11.68 |
4.13 |
-8.7 |
-0.8 |
0 |
|
|
426823 |
135154083 |
1 |
ON3C11H17 |
AB3C11D17 |
-28.78 |
1.7 |
-9.06 |
-0.2 |
0 |
|
|
426824 |
135154084 |
1 |
OS2N5C14H15 |
AB2C5D14E15 |
82.07 |
8.71 |
-9.42 |
-1.61 |
0 |
|
|
426825 |
135154085 |
1 |
O3N7C22H25 |
A3B7C22D25 |
10.84 |
6.51 |
-8.83 |
-1.1 |
0 |
|
|
426826 |
135154086 |
1 |
O2N6C27H28 |
A2B6C27D28 |
35.79 |
5.63 |
-9.04 |
-0.92 |
0 |
|
|
426827 |
135154089 |
1 |
ClFO3N4C20H22 |
ABC3D4E20F22 |
-115.42 |
7.81 |
-9.18 |
-0.84 |
0 |
|
|
426828 |
135154090 |
1 |
ClS2N3O3F5H5C11 |
AB2C3D3E5F5G11 |
-289.9 |
3.57 |
-10.34 |
-2.52 |
0 |
|
|
426829 |
135154091 |
1 |
O3N6C26H30 |
A3B6C26D30 |
-25.83 |
3.43 |
-8.8 |
-0.89 |
0 |
|
|
426830 |
135154092 |
1 |
OSF2N3H13C15 |
ABC2D3E13F15 |
-46.88 |
4.33 |
-9.63 |
-1.68 |
0 |
|
|
426831 |
135154093 |
2 |
ON3C11H12 |
AB3C11D12 |
31.01 |
4.0 |
-9.15 |
-1.07 |
0 |
|
|
426832 |
135154094 |
1 |
ClSO2N4C19H21 |
ABC2D4E19F21 |
-23.94 |
5.78 |
-8.81 |
-0.78 |
0 |
|
|
426833 |
135154095 |
2 |
ON2C7H9 |
AB2C7D9 |
-57.04 |
2.66 |
-8.54 |
-0.01 |
0 |
|
|
426834 |
135154096 |
1 |
O2N6H22C25 |
A2B6C22D25 |
60.0 |
8.27 |
-9.41 |
-1.13 |
0 |
|
|
426835 |
135154097 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-76.9 |
4.66 |
-8.71 |
-0.43 |
0 |
|
|
426836 |
135154098 |
1 |
Cl2N2O2H6C7 |
A2B2C2D6E7 |
-40.67 |
1.7 |
-10.5 |
-1.88 |
0 |
|
|
426837 |
135154099 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-86.84 |
3.26 |
-9.12 |
-0.96 |
0 |
|
|
426838 |
135154100 |
2 |
NO2C10H11 |
AB2C10D11 |
-114.45 |
4.5 |
-9.17 |
-0.51 |
0 |
|
|
426839 |
135154101 |
1 |
O4N5C21H25 |
A4B5C21D25 |
-86.03 |
5.89 |
-8.81 |
-0.71 |
0 |
|
|
426840 |
135154109 |
1 |
O2N6C27H28 |
A2B6C27D28 |
36.34 |
8.94 |
-9.06 |
-0.92 |
0 |
|
|
426841 |
135154118 |
1 |
O2N4C17H22 |
A2B4C17D22 |
-22.53 |
3.57 |
-8.68 |
-0.31 |
0 |
|
|
426842 |
135154123 |
1 |
ClN2O3C17H19 |
AB2C3D17E19 |
-78.67 |
4.3 |
-8.57 |
-0.35 |
0 |
|
|
426843 |
135154131 |
1 |
BrO3H23C24 |
AB3C23D24 |
-60.65 |
4.86 |
-8.45 |
-0.63 |
0 |
|
|
426844 |
135154134 |
1 |
NO6C72H143 |
AB6C72D143 |
-600.45 |
4.88 |
-10.06 |
0.61 |
0 |
|
|
426845 |
135154139 |
1 |
ClNO3C10H10 |
ABC3D10E10 |
-101.2 |
2.81 |
-9.86 |
-1.17 |
0 |
|
|
426846 |
135154140 |
1 |
ClO3N6C23H25 |
AB3C6D23E25 |
-15.25 |
5.28 |
-8.81 |
-0.99 |
0 |
|
|
426847 |
135154141 |
1 |
FO3N6C23H25 |
AB3C6D23E25 |
-53.71 |
2.8 |
-8.84 |
-1.18 |
0 |
|
|
426848 |
135154156 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-85.61 |
2.74 |
-8.72 |
-1.08 |
0 |
|
|
426849 |
135154157 |
1 |
O3N6C25H26 |
A3B6C25D26 |
10.57 |
6.66 |
-8.84 |
-1.06 |
0 |
|
|
426850 |
135154158 |
1 |
ClO3N5C27H30 |
AB3C5D27E30 |
-43.82 |
4.22 |
-8.64 |
-0.92 |
0 |
|
|
426851 |
135154169 |
1 |
IN3O4C19H22 |
AB3C4D19E22 |
-90.44 |
2.03 |
-8.72 |
-1.41 |
0 |
|
|
426852 |
135154170 |
1 |
SN2O5C21H22 |
AB2C5D21E22 |
-149.38 |
7.7 |
-9.01 |
-1.18 |
0 |
|
|
426853 |
135154172 |
2 |
ClC3O3H4 |
AB3C3D4 |
-290.78 |
4.65 |
-10.95 |
-1.42 |
0 |
|
|
426854 |
135154175 |
1 |
ISN3O5C19H24 |
ABC3D5E19F24 |
-135.42 |
4.7 |
-8.62 |
-1.19 |
0 |
|
|
426855 |
135154180 |
1 |
ClSN3O4C25H26 |
ABC3D4E25F26 |
-91.98 |
3.68 |
-9.17 |
-0.78 |
0 |
|
|
426856 |
135154181 |
1 |
OCl2S2F3N3H6C11 |
AB2C2D3E3F6G11 |
-136.2 |
3.57 |
-9.81 |
-2.31 |
0 |
|
|
426857 |
135154184 |
1 |
O2N5C20H21 |
A2B5C20D21 |
26.12 |
5.74 |
-8.86 |
-0.83 |
0 |
|
|
426858 |
135154186 |
1 |
O3N5C18H21 |
A3B5C18D21 |
-38.38 |
5.69 |
-8.82 |
-1.03 |
0 |
|
|
426859 |
135154187 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-34.83 |
5.93 |
-8.78 |
-0.86 |
0 |