List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
12871 |
147390 |
1 |
O2Cl4C5 |
A2B4C5 |
-55.54 |
3.16 |
-9.74 |
-2.17 |
0 |
|
|
12872 |
147404 |
1 |
BrO2H11C15 |
AB2C11D15 |
12.37 |
1.89 |
-9.82 |
-1.13 |
0 |
|
|
12873 |
147405 |
2 |
O2C5H5 |
A2B5C5 |
-133.44 |
2.08 |
-10.51 |
-1.97 |
0 |
|
|
12874 |
147407 |
1 |
O8C17H24 |
A8B17C24 |
-311.15 |
3.78 |
-10.01 |
0.03 |
0 |
|
|
12875 |
147411 |
2 |
SO3C6H13 |
AB3C6D13 |
-301.42 |
5.14 |
-10.86 |
0.18 |
0 |
|
|
12876 |
147488 |
1 |
NO3C13H13 |
AB3C13D13 |
-86.25 |
6.79 |
-8.98 |
-0.55 |
0 |
|
|
12877 |
147489 |
1 |
NO3C14H15 |
AB3C14D15 |
-96.2 |
6.82 |
-8.72 |
-0.42 |
0 |
|
|
12878 |
147491 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-48.53 |
8.88 |
-9.13 |
-1.8 |
0 |
|
|
12879 |
147509 |
1 |
O2C21H28 |
A2B21C28 |
-55.89 |
4.72 |
-8.5 |
0.16 |
0 |
|
|
12880 |
147512 |
1 |
NO6H9C12 |
AB6C9D12 |
-213.11 |
9.61 |
-10.72 |
-2.08 |
0 |
|
|
12881 |
147538 |
1 |
OBr2C4H6 |
AB2C4D6 |
-40.15 |
2.38 |
-10.61 |
-1.1 |
0 |
|
|
12882 |
147539 |
1 |
NPCl2O4C8H8 |
ABC2D4E8F8 |
-106.72 |
6.11 |
-10.29 |
-1.42 |
0 |
|
|
12883 |
147641 |
1 |
N2O2C7H10 |
A2B2C7D10 |
-78.6 |
3.7 |
-9.71 |
-0.77 |
0 |
|
|
12884 |
147684 |
3 |
C5H6 |
A5B6 |
6.28 |
0.6 |
-8.59 |
0.16 |
0 |
|
|
12885 |
147686 |
1 |
N3C9H11 |
A3B9C11 |
59.71 |
6.3 |
-9.4 |
-0.2 |
0 |
|
|
12886 |
147769 |
1 |
OBr2N6C18H20 |
AB2C6D18E20 |
125.85 |
15.07 |
-8.29 |
-1.89 |
0 |
|
|
12887 |
147770 |
1 |
ON6C18H19 |
AB6C18D19 |
143.03 |
3.03 |
0.0 |
0.0 |
1 |
|
|
12888 |
147793 |
1 |
O3N4C10H12 |
A3B4C10D12 |
2.87 |
11.46 |
-9.71 |
-0.89 |
0 |
|
|
12889 |
147794 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-17.65 |
8.98 |
-9.14 |
-0.01 |
0 |
|
|
12890 |
147801 |
2 |
NOC7H7 |
ABC7D7 |
-9.91 |
4.24 |
-9.11 |
-0.74 |
0 |
|
|
12891 |
147838 |
1 |
SO3H16C20 |
AB3C16D20 |
-60.68 |
6.55 |
-8.46 |
-1.25 |
0 |
|
|
12892 |
147846 |
1 |
SO3H16C20 |
AB3C16D20 |
-55.33 |
5.21 |
-8.42 |
-1.36 |
0 |
|
|
12893 |
147878 |
2 |
NO2H4C7 |
AB2C4D7 |
8.5 |
7.33 |
-9.29 |
-1.83 |
0 |
|
|
12894 |
147892 |
2 |
N2O3C7H8 |
A2B3C7D8 |
-131.27 |
4.45 |
-9.26 |
-1.61 |
0 |
|
|
12895 |
147907 |
1 |
FH11C20 |
AB11C20 |
41.6 |
2.05 |
-8.88 |
-1.21 |
0 |