List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
259700 |
103172254 |
1 |
N2O3C14H22 |
A2B3C14D22 |
-99.23 |
3.7 |
-8.6 |
-0.05 |
0 |
|
|
259701 |
103172284 |
1 |
O2N3C16H17 |
A2B3C16D17 |
15.31 |
3.54 |
-9.38 |
-0.62 |
0 |
|
|
259702 |
103172304 |
2 |
NOC7H12 |
ABC7D12 |
-72.07 |
1.82 |
-9.07 |
-0.26 |
0 |
|
|
259703 |
103172319 |
1 |
ClN2O2C16H19 |
AB2C2D16E19 |
-30.78 |
4.0 |
-9.05 |
-0.39 |
0 |
|
|
259704 |
103172342 |
2 |
NOC8H14 |
ABC8D14 |
-82.32 |
5.19 |
-8.64 |
-0.2 |
0 |
|
|
259705 |
103172370 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-56.31 |
2.54 |
-8.62 |
-0.27 |
0 |
|
|
259706 |
103172383 |
1 |
FN2O2C15H17 |
AB2C2D15E17 |
-75.2 |
6.19 |
-8.32 |
-0.43 |
0 |
|
|
259707 |
103172456 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-84.12 |
2.7 |
-8.94 |
-0.26 |
0 |
|
|
259708 |
103172458 |
1 |
BrClN2O2C14H14 |
ABC2D2E14F14 |
-23.21 |
7.17 |
-8.54 |
-0.47 |
0 |
|
|
259709 |
103172582 |
2 |
ON2C6H8 |
AB2C6D8 |
4.76 |
2.6 |
-7.98 |
-0.2 |
0 |
|
|
259710 |
103172632 |
1 |
BrN2O2C16H19 |
AB2C2D16E19 |
-19.67 |
4.59 |
-8.4 |
-0.1 |
0 |
|
|
259711 |
103172786 |
1 |
N2O3C14H22 |
A2B3C14D22 |
-81.28 |
5.88 |
-8.75 |
-0.27 |
0 |
|
|
259712 |
103172839 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-57.85 |
6.54 |
-9.25 |
-0.37 |
0 |
|
|
259713 |
103172857 |
1 |
BrN2O3H13C15 |
AB2C3D13E15 |
-16.93 |
4.64 |
-9.4 |
-1.1 |
0 |
|
|
259714 |
103172867 |
1 |
SO2N3C12H19 |
AB2C3D12E19 |
-35.61 |
8.08 |
-8.34 |
-0.51 |
0 |
|
|
259715 |
103172894 |
1 |
NSO2H13C16 |
ABC2D13E16 |
-13.71 |
2.95 |
-9.03 |
-1.14 |
0 |
|
|
259716 |
103172928 |
1 |
FNSO2H10C12 |
ABCD2E10F12 |
-75.63 |
2.14 |
-9.27 |
-1.28 |
0 |
|
|
259717 |
103172929 |
1 |
NSO6C12H17 |
ABC6D12E17 |
-226.41 |
4.39 |
-9.8 |
-0.73 |
0 |
|
|
259718 |
103172935 |
1 |
NSO3C13H13 |
ABC3D13E13 |
-74.88 |
3.02 |
-8.88 |
-0.98 |
0 |
|
|
259719 |
103172948 |
1 |
SO4C15H16 |
AB4C15D16 |
-121.72 |
4.93 |
-8.57 |
-0.57 |
0 |
|
|
259720 |
103172949 |
1 |
SO2F3H11C14 |
AB2C3D11E14 |
-202.87 |
3.0 |
-9.14 |
-1.05 |
0 |
|
|
259721 |
103172957 |
1 |
SO3C15H16 |
AB3C15D16 |
-86.33 |
4.97 |
-8.66 |
-0.72 |
0 |
|
|
259722 |
103172989 |
1 |
BrSO3H9C11 |
ABC3D9E11 |
-66.97 |
3.27 |
-8.93 |
-1.17 |
0 |
|
|
259723 |
103173037 |
1 |
SO4C15H16 |
AB4C15D16 |
-124.08 |
2.1 |
-8.87 |
-0.77 |
0 |
|
|
259724 |
103173071 |
2 |
NO3C9H10 |
AB3C9D10 |
-194.49 |
6.97 |
-9.67 |
-0.53 |
0 |
|
|
259725 |
103173116 |
1 |
SN2O2C11H12 |
AB2C2D11E12 |
-20.84 |
5.74 |
-8.59 |
-0.83 |
0 |
|
|
259726 |
103173154 |
1 |
BrNSO2H10C12 |
ABCD2E10F12 |
-35.26 |
3.82 |
-9.09 |
-1.21 |
0 |
|
|
259727 |
103173201 |
1 |
BrSN2O2C13H13 |
ABC2D2E13F13 |
-39.07 |
3.5 |
-9.21 |
-1.46 |
0 |
|
|
259728 |
103173225 |
1 |
BrSN2O2C14H15 |
ABC2D2E14F15 |
-21.42 |
4.42 |
-8.6 |
-0.52 |
0 |
|
|
259729 |
103173235 |
1 |
SN2O2C11H18 |
AB2C2D11E18 |
-57.02 |
3.74 |
-8.59 |
-0.44 |
0 |
|
|
259730 |
103173237 |
1 |
SN2O2C12H20 |
AB2C2D12E20 |
-56.24 |
5.92 |
-8.28 |
-0.21 |
0 |
|
|
259731 |
103173276 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-32.13 |
6.14 |
-8.55 |
-0.27 |
0 |
|
|
259732 |
103173290 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-81.15 |
3.57 |
-8.66 |
-0.16 |
0 |
|
|
259733 |
103173301 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-18.97 |
3.79 |
-7.91 |
-0.31 |
0 |
|
|
259734 |
103173303 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-21.91 |
3.91 |
-7.93 |
-0.1 |
0 |
|
|
259735 |
103173319 |
1 |
NO4C16H19 |
AB4C16D19 |
-107.8 |
6.81 |
-8.72 |
-0.52 |
0 |
|
|
259736 |
103173326 |
1 |
BrNO4C15H16 |
ABC4D15E16 |
-98.14 |
3.78 |
-9.0 |
-0.54 |
0 |
|
|
259737 |
103173333 |
1 |
N2O5C14H14 |
A2B5C14D14 |
-145.53 |
6.93 |
-9.7 |
-1.01 |
0 |
|
|
259738 |
103173337 |
1 |
N2O5C14H14 |
A2B5C14D14 |
-150.45 |
9.87 |
-9.62 |
-1.1 |
0 |
|
|
259739 |
103173360 |
1 |
BrNO3C15H16 |
ABC3D15E16 |
-57.9 |
2.62 |
-8.96 |
-0.61 |
0 |
|
|
259740 |
103173361 |
1 |
NBr2O3C15H15 |
AB2C3D15E15 |
-56.52 |
2.0 |
-9.17 |
-0.89 |
0 |
|
|
259741 |
103173372 |
1 |
BrNO3C16H18 |
ABC3D16E18 |
-63.98 |
6.59 |
-8.44 |
-0.4 |
0 |
|
|
259742 |
103173420 |
1 |
N2O3C13H22 |
A2B3C13D22 |
-103.85 |
4.32 |
-9.16 |
-0.42 |
0 |
|
|
259743 |
103173431 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-102.38 |
2.21 |
-9.14 |
-0.39 |
0 |
|
|
259744 |
103173440 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-15.14 |
2.76 |
-8.45 |
-0.2 |
0 |
|
|
259745 |
103173444 |
1 |
NO3C12H17 |
AB3C12D17 |
-99.96 |
1.27 |
-9.44 |
-0.29 |
0 |
|
|
259746 |
103173445 |
1 |
NO3C13H19 |
AB3C13D19 |
-104.51 |
4.95 |
-8.72 |
-0.13 |
0 |
|
|
259747 |
103173475 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-141.76 |
4.88 |
-8.96 |
-0.4 |
0 |
|
|
259748 |
103173476 |
2 |
NO2C7H10 |
AB2C7D10 |
-109.78 |
6.83 |
-9.26 |
-0.5 |
0 |
|
|
259749 |
103173478 |
1 |
N2O4C15H24 |
A2B4C15D24 |
-141.02 |
3.83 |
-8.64 |
-0.39 |
0 |