List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
213445 |
81063740 |
1 |
NO4C15H21 |
AB4C15D21 |
-175.57 |
2.96 |
-8.59 |
0.29 |
0 |
|
|
213446 |
81063744 |
2 |
NO2C6H8 |
AB2C6D8 |
-163.99 |
2.7 |
-9.32 |
-0.8 |
0 |
|
|
213447 |
81063751 |
1 |
NO4C16H23 |
AB4C16D23 |
-178.09 |
1.44 |
-9.04 |
-0.22 |
0 |
|
|
213448 |
81063752 |
1 |
NO3C14H19 |
AB3C14D19 |
-133.35 |
4.91 |
-9.52 |
0.24 |
0 |
|
|
213449 |
81063773 |
1 |
N2O4C15H16 |
A2B4C15D16 |
-142.67 |
6.71 |
-9.07 |
-1.06 |
0 |
|
|
213450 |
81063774 |
1 |
NO3C15H27 |
AB3C15D27 |
-185.68 |
4.5 |
-9.94 |
0.54 |
0 |
|
|
213451 |
81063782 |
1 |
N2O4C15H16 |
A2B4C15D16 |
-150.74 |
2.85 |
-9.27 |
-1.27 |
0 |
|
|
213452 |
81063786 |
1 |
NO3C16H25 |
AB3C16D25 |
-177.03 |
3.82 |
-9.72 |
0.56 |
0 |
|
|
213453 |
81063787 |
1 |
NO3C11H21 |
AB3C11D21 |
-172.87 |
3.08 |
-9.83 |
0.46 |
0 |
|
|
213454 |
81063788 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-184.54 |
9.58 |
-9.52 |
-0.6 |
0 |
|
|
213455 |
81063789 |
1 |
NO4C15H21 |
AB4C15D21 |
-176.01 |
4.16 |
-8.9 |
-0.02 |
0 |
|
|
213456 |
81063797 |
1 |
ClN2O3C12H17 |
AB2C3D12E17 |
-136.52 |
4.32 |
-9.12 |
-0.1 |
0 |
|
|
213457 |
81063812 |
1 |
SN2O4C14H20 |
AB2C4D14E20 |
-175.74 |
4.69 |
-9.6 |
-0.97 |
0 |
|
|
213458 |
81063815 |
1 |
NO5C12H21 |
AB5C12D21 |
-258.98 |
3.12 |
-9.8 |
0.37 |
0 |
|
|
213459 |
81063816 |
1 |
NSO3C11H15 |
ABC3D11E15 |
-118.55 |
3.68 |
-9.51 |
-0.9 |
0 |
|
|
213460 |
81063820 |
1 |
NO3C16H23 |
AB3C16D23 |
-151.5 |
4.2 |
-9.2 |
0.14 |
0 |
|
|
213461 |
81063821 |
1 |
NSO3C15H19 |
ABC3D15E19 |
-129.59 |
4.19 |
-8.67 |
-0.15 |
0 |
|
|
213462 |
81063823 |
1 |
NF2O3C14H17 |
AB2C3D14E17 |
-226.98 |
3.92 |
-9.99 |
-0.58 |
0 |
|
|
213463 |
81063824 |
1 |
NO3C15H21 |
AB3C15D21 |
-137.59 |
3.55 |
-9.49 |
0.27 |
0 |
|
|
213464 |
81063827 |
1 |
NO5C15H19 |
AB5C15D19 |
-195.16 |
2.41 |
-9.02 |
-0.11 |
0 |
|
|
213465 |
81063829 |
1 |
NSO3C16H23 |
ABC3D16E23 |
-145.28 |
2.75 |
-9.06 |
-0.43 |
0 |
|
|
213466 |
81063830 |
1 |
NO5C14H19 |
AB5C14D19 |
-201.95 |
5.69 |
-9.2 |
-0.34 |
0 |
|
|
213467 |
81063831 |
1 |
SN2O3C15H20 |
AB2C3D15E20 |
-96.38 |
4.53 |
-7.9 |
-0.59 |
0 |
|
|
213468 |
81063833 |
1 |
ClSN2O2C15H19 |
ABC2D2E15F19 |
-72.11 |
1.37 |
-8.22 |
-0.98 |
0 |
|
|
213469 |
81063839 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-78.35 |
3.47 |
-8.74 |
0.31 |
0 |
|
|
213470 |
81063841 |
1 |
SO2N4C14H22 |
AB2C4D14E22 |
-48.73 |
4.22 |
-8.23 |
-0.37 |
0 |
|
|
213471 |
81063843 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-52.14 |
0.77 |
-8.84 |
-0.24 |
0 |
|
|
213472 |
81063844 |
1 |
OSN2C17H26 |
ABC2D17E26 |
-20.75 |
1.73 |
-8.6 |
-0.45 |
0 |
|
|
213473 |
81063847 |
1 |
NSO5C14H23 |
ABC5D14E23 |
-200.67 |
7.54 |
-9.18 |
-0.57 |
0 |
|
|
213474 |
81063848 |
1 |
ClNSO5C13H20 |
ABCD5E13F20 |
-198.76 |
5.44 |
-9.36 |
-0.88 |
0 |
|
|
213475 |
81063850 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-73.94 |
2.49 |
-8.8 |
0.25 |
0 |
|
|
213476 |
81063853 |
1 |
NSO4C15H25 |
ABC4D15E25 |
-181.68 |
5.35 |
-9.38 |
-0.5 |
0 |
|
|
213477 |
81063872 |
1 |
N2O2C17H28 |
A2B2C17D28 |
-42.27 |
2.0 |
-8.81 |
0.31 |
0 |
|
|
213478 |
81063874 |
1 |
SN3O3C14H29 |
AB3C3D14E29 |
-120.59 |
5.31 |
-9.06 |
0.02 |
0 |
|
|
213479 |
81063875 |
1 |
SN3O3C14H31 |
AB3C3D14E31 |
-152.65 |
3.65 |
-9.04 |
0.02 |
0 |
|
|
213480 |
81063876 |
1 |
SO2N3C12H23 |
AB2C3D12E23 |
-58.41 |
1.22 |
-8.51 |
-0.12 |
0 |
|
|
213481 |
81063877 |
1 |
ON5C9H17 |
AB5C9D17 |
13.14 |
6.6 |
-8.73 |
0.06 |
0 |
|
|
213482 |
81063878 |
1 |
ClSN3O3C13H24 |
ABC3D3E13F24 |
-132.72 |
5.33 |
-9.39 |
0.2 |
0 |
|
|
213483 |
81063880 |
1 |
ClNSO4C14H22 |
ABCD4E14F22 |
-162.6 |
4.96 |
-9.38 |
-0.55 |
0 |
|
|
213484 |
81063881 |
1 |
O2N6C11H22 |
A2B6C11D22 |
-36.66 |
1.03 |
-9.19 |
-0.1 |
0 |
|
|
213485 |
81063882 |
1 |
N2O2C15H34 |
A2B2C15D34 |
-128.42 |
1.4 |
-8.79 |
2.02 |
0 |
|
|
213486 |
81063883 |
1 |
ON5C11H21 |
AB5C11D21 |
-12.68 |
3.26 |
-8.98 |
0.02 |
0 |
|
|
213487 |
81063884 |
1 |
N2O2C11H26 |
A2B2C11D26 |
-110.16 |
0.63 |
-8.71 |
2.05 |
0 |
|
|
213488 |
81063886 |
2 |
NOC7H15 |
ABC7D15 |
-100.08 |
3.09 |
-8.75 |
2.05 |
0 |
|
|
213489 |
81063887 |
1 |
N2O2C11H24 |
A2B2C11D24 |
-82.8 |
2.45 |
-8.65 |
2.17 |
0 |
|
|
213490 |
81063888 |
2 |
NOC7H16 |
ABC7D16 |
-123.45 |
1.07 |
-8.82 |
2.01 |
0 |
|
|
213491 |
81063894 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-78.67 |
2.08 |
-8.62 |
0.51 |
0 |
|
|
213492 |
81063897 |
1 |
ClNSO3C7H16 |
ABCD3E7F16 |
-150.06 |
5.61 |
-9.78 |
0.17 |
0 |
|
|
213493 |
81063915 |
1 |
BrFNO3C12H13 |
ABCD3E12F13 |
-161.61 |
2.89 |
-10.06 |
-1.01 |
0 |
|
|
213494 |
81063916 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-98.14 |
4.7 |
-10.19 |
-1.25 |
0 |