List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
30723 |
841768 |
1 |
ClNO4C15H16 |
ABC4D15E16 |
-148.63 |
7.49 |
-8.79 |
-0.44 |
0 |
|
|
30724 |
841769 |
1 |
ClNO4C15H16 |
ABC4D15E16 |
-149.11 |
4.91 |
-8.84 |
-0.46 |
0 |
|
|
30725 |
841770 |
1 |
ClNO4C15H16 |
ABC4D15E16 |
-150.95 |
8.47 |
-8.96 |
-0.61 |
0 |
|
|
30726 |
841771 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-57.85 |
8.7 |
-8.59 |
-0.95 |
0 |
|
|
30727 |
841772 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-57.8 |
7.5 |
-8.71 |
-0.43 |
0 |
|
|
30728 |
841773 |
1 |
OSF3N3H8C12 |
ABC3D3E8F12 |
-127.24 |
3.19 |
-9.25 |
-0.94 |
0 |
|
|
30729 |
841774 |
1 |
FN4O4H11C12 |
AB4C4D11E12 |
-68.9 |
3.59 |
-9.23 |
-1.81 |
0 |
|
|
30730 |
841775 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-78.25 |
5.9 |
-9.11 |
-0.22 |
0 |
|
|
30731 |
841776 |
1 |
BrON3C12H12 |
ABC3D12E12 |
14.69 |
2.19 |
-8.93 |
-0.63 |
0 |
|
|
30732 |
841777 |
1 |
NOC17H29 |
ABC17D29 |
-77.59 |
4.2 |
-9.08 |
1.46 |
0 |
|
|
30733 |
841778 |
1 |
OS2N3C12H19 |
AB2C3D12E19 |
-11.65 |
4.79 |
-8.73 |
-0.99 |
0 |
|
|
30734 |
841779 |
1 |
BrNSO2C14H22 |
ABCD2E14F22 |
-83.7 |
4.23 |
-9.43 |
-0.87 |
0 |
|
|
30735 |
841780 |
1 |
BrNSO2C14H22 |
ABCD2E14F22 |
-87.69 |
4.44 |
-9.5 |
-0.85 |
0 |
|
|
30736 |
841781 |
1 |
BrNSO2C14H22 |
ABCD2E14F22 |
-84.46 |
4.85 |
-9.33 |
-0.83 |
0 |
|
|
30737 |
841782 |
1 |
ClN2O2H11C12 |
AB2C2D11E12 |
-39.52 |
5.29 |
-9.35 |
-1.34 |
0 |
|
|
30738 |
841784 |
1 |
ClN2O2H11C12 |
AB2C2D11E12 |
-36.87 |
3.9 |
-9.44 |
-1.33 |
0 |
|
|
30739 |
841785 |
1 |
O2N3C11H15 |
A2B3C11D15 |
-47.68 |
3.33 |
-9.43 |
-1.14 |
0 |
|
|
30740 |
841786 |
1 |
O2N3C11H15 |
A2B3C11D15 |
-47.38 |
3.03 |
-9.43 |
-1.12 |
0 |
|
|
30741 |
841787 |
1 |
ON5C7H11 |
AB5C7D11 |
26.04 |
2.39 |
-9.88 |
-0.72 |
0 |
|
|
30742 |
841788 |
1 |
ClNO3C18H20 |
ABC3D18E20 |
-97.15 |
7.16 |
-8.17 |
-0.09 |
0 |
|
|
30743 |
841789 |
1 |
BrFNOC12H15 |
ABCDE12F15 |
-89.44 |
3.75 |
-9.05 |
-0.51 |
0 |
|
|
30744 |
841790 |
1 |
BrN2O2H11C12 |
AB2C2D11E12 |
-24.43 |
7.2 |
-9.36 |
-1.38 |
0 |
|
|
30745 |
841791 |
1 |
N2S2O3C13H14 |
A2B2C3D13E14 |
-75.0 |
7.59 |
-9.1 |
-0.69 |
0 |
|
|
30746 |
841792 |
1 |
O3C11H14 |
A3B11C14 |
-115.38 |
6.87 |
-9.34 |
-0.72 |
0 |
|
|
30747 |
841793 |
1 |
NO3C13H17 |
AB3C13D17 |
-134.37 |
3.03 |
-8.96 |
0.26 |
0 |
|
|
30748 |
841794 |
1 |
NOCl4H9C14 |
ABC4D9E14 |
-33.88 |
3.53 |
-9.16 |
-0.83 |
0 |
|
|
30749 |
841795 |
1 |
SCl2F2N2H8C13 |
AB2C2D2E8F13 |
-46.21 |
4.78 |
-9.06 |
-1.2 |
0 |
|
|
30750 |
841796 |
1 |
NO3C18H23 |
AB3C18D23 |
-123.36 |
6.33 |
-9.64 |
0.05 |
0 |
|
|
30751 |
841797 |
1 |
ClN2O2H11C12 |
AB2C2D11E12 |
-36.43 |
2.82 |
-9.27 |
-1.35 |
0 |
|
|
30752 |
841798 |
1 |
NO2C14H15 |
AB2C14D15 |
-51.26 |
2.14 |
-9.39 |
-1.18 |
0 |
|
|
30753 |
841799 |
1 |
ClNO4C16H16 |
ABC4D16E16 |
-149.92 |
2.96 |
-9.48 |
-1.86 |
0 |
|
|
30754 |
841800 |
1 |
ClNO4C16H16 |
ABC4D16E16 |
-149.52 |
2.52 |
-9.42 |
-1.83 |
0 |
|
|
30755 |
841801 |
1 |
ClNO4C16H16 |
ABC4D16E16 |
-149.22 |
2.34 |
-9.51 |
-1.81 |
0 |
|
|
30756 |
841802 |
1 |
ClNO4C16H16 |
ABC4D16E16 |
-147.92 |
1.14 |
-9.48 |
-1.72 |
0 |
|
|
30757 |
841803 |
1 |
N5C17H21 |
A5B17C21 |
70.16 |
4.69 |
-8.76 |
-0.41 |
0 |
|
|
30758 |
841804 |
1 |
N6C19H20 |
A6B19C20 |
135.17 |
6.78 |
-8.87 |
-0.7 |
0 |
|
|
30759 |
841806 |
1 |
N6C19H20 |
A6B19C20 |
135.07 |
6.58 |
-8.86 |
-0.7 |
0 |
|
|
30760 |
841808 |
1 |
N6C19H20 |
A6B19C20 |
133.56 |
6.55 |
-8.93 |
-0.71 |
0 |
|
|
30761 |
841809 |
6 |
NC3H3 |
AB3C3 |
141.73 |
4.63 |
-9.0 |
-0.74 |
0 |
|
|
30762 |
841811 |
6 |
NC3H3 |
AB3C3 |
142.41 |
3.09 |
-8.96 |
-0.79 |
0 |
|
|
30763 |
841812 |
6 |
NC3H3 |
AB3C3 |
145.16 |
5.33 |
-8.97 |
-0.76 |
0 |
|
|
30764 |
841813 |
6 |
NC3H3 |
AB3C3 |
140.93 |
3.72 |
-8.98 |
-0.76 |
0 |
|
|
30765 |
841815 |
1 |
ClOSN3H10C12 |
ABCD3E10F12 |
48.85 |
3.86 |
-8.77 |
-1.26 |
0 |
|
|
30766 |
841820 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-88.0 |
7.95 |
-8.31 |
-0.71 |
0 |
|
|
30767 |
841823 |
1 |
SO3N4H10C12 |
AB3C4D10E12 |
60.38 |
8.55 |
-8.81 |
-1.62 |
0 |
|
|
30768 |
841825 |
1 |
ClO2N3H10C12 |
AB2C3D10E12 |
-3.88 |
2.96 |
-8.77 |
-0.93 |
0 |
|
|
30769 |
841832 |
1 |
ClOSN2H11C12 |
ABCD2E11F12 |
5.23 |
1.46 |
-9.17 |
-1.08 |
0 |
|
|
30770 |
841844 |
1 |
NF2O3H11C15 |
AB2C3D11E15 |
-151.69 |
4.37 |
-8.91 |
-0.82 |
0 |
|
|
30771 |
841845 |
1 |
ClOSN2H13C15 |
ABCD2E13F15 |
10.27 |
3.48 |
-8.22 |
-1.16 |
0 |
|
|
30772 |
841846 |
1 |
SN3O4H9C10 |
AB3C4D9E10 |
-22.3 |
1.48 |
-9.65 |
-2.31 |
0 |
|
|
30773 |
841849 |
1 |
ClNOC12H14 |
ABCD12E14 |
-25.02 |
2.41 |
-9.61 |
-0.23 |
0 |
|
|
30774 |
841850 |
1 |
ClNOC12H14 |
ABCD12E14 |
-25.15 |
2.35 |
-9.64 |
-0.25 |
0 |
|
|
30775 |
841854 |
1 |
SCl2N3H11C13 |
AB2C3D11E13 |
53.76 |
4.66 |
-8.85 |
-0.82 |
0 |
|
|
30776 |
841856 |
1 |
ClNOC13H16 |
ABCD13E16 |
-31.14 |
1.23 |
-9.45 |
-0.23 |
0 |
|
|
30777 |
841859 |
1 |
ClNOC13H16 |
ABCD13E16 |
-30.91 |
1.47 |
-9.41 |
-0.19 |
0 |
|
|
30778 |
841861 |
1 |
SCl2N3C12H15 |
AB2C3D12E15 |
24.74 |
6.84 |
-8.63 |
-0.59 |
0 |
|
|
30779 |
841863 |
1 |
NOC14H19 |
ABC14D19 |
-31.09 |
3.99 |
-9.32 |
0.2 |
0 |
|
|
30780 |
841864 |
1 |
NOC16H23 |
ABC16D23 |
-40.85 |
3.86 |
-9.25 |
0.24 |
0 |
|
|
30781 |
841870 |
1 |
BrNOSC14H14 |
ABCDE14F14 |
-11.49 |
2.42 |
-8.75 |
-0.59 |
0 |
|
|
30782 |
841871 |
1 |
ClFN2O2H8C11 |
ABC2D2E8F11 |
-51.83 |
4.52 |
-9.17 |
-0.84 |
0 |
|
|
30783 |
841875 |
1 |
ClN2O2F3H8C12 |
AB2C2D3E8F12 |
-168.58 |
4.31 |
-9.45 |
-1.21 |
0 |
|
|
30784 |
841876 |
1 |
N2O3H12C13 |
A2B3C12D13 |
-42.88 |
6.34 |
-9.28 |
-1.04 |
0 |
|
|
30785 |
841877 |
1 |
OSN4H16C18 |
ABC4D16E18 |
69.88 |
4.99 |
-9.23 |
-0.95 |
0 |
|
|
30786 |
841879 |
1 |
OSN4H14C17 |
ABC4D14E17 |
79.34 |
4.65 |
-9.23 |
-1.01 |
0 |
|
|
30787 |
841881 |
2 |
OC7H9 |
AB7C9 |
-71.49 |
5.49 |
-9.59 |
-0.07 |
0 |
|
|
30788 |
841884 |
2 |
OC7H9 |
AB7C9 |
-71.5 |
5.36 |
-9.57 |
-0.05 |
0 |
|
|
30789 |
841885 |
1 |
ClSN2O2H13C17 |
ABC2D2E13F17 |
6.57 |
4.9 |
-9.1 |
-0.9 |
0 |
|
|
30790 |
841895 |
1 |
OCl3N3H10C12 |
AB3C3D10E12 |
-1.52 |
2.19 |
-9.39 |
-1.0 |
0 |
|
|
30791 |
841905 |
1 |
ClOSN3C13H18 |
ABCD3E13F18 |
-15.89 |
5.13 |
-8.74 |
-0.52 |
0 |
|
|
30792 |
841908 |
1 |
NO3C11H15 |
AB3C11D15 |
-121.45 |
1.94 |
-9.04 |
0.06 |
0 |
|
|
30793 |
841915 |
1 |
ClFNOC12H15 |
ABCDE12F15 |
-106.66 |
3.74 |
-9.79 |
-0.58 |
0 |
|
|
30794 |
841916 |
1 |
ClNOC12H16 |
ABCD12E16 |
-61.87 |
2.31 |
-9.57 |
-0.22 |
0 |
|
|
30795 |
841920 |
1 |
ClON2H13C14 |
ABC2D13E14 |
-12.01 |
2.05 |
-9.17 |
-0.35 |
0 |
|
|
30796 |
841924 |
1 |
NO2C23H23 |
AB2C23D23 |
-22.61 |
3.87 |
-8.72 |
-0.3 |
0 |
|
|
30797 |
841928 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-19.39 |
5.77 |
-8.39 |
-0.23 |
0 |
|
|
30798 |
841929 |
1 |
ClSN3H12C13 |
ABC3D12E13 |
58.2 |
4.88 |
-8.94 |
-0.92 |
0 |
|
|
30799 |
841930 |
1 |
ON4C12H14 |
AB4C12D14 |
26.52 |
3.85 |
-9.3 |
-0.92 |
0 |
|
|
30800 |
841938 |
1 |
ON3C15H17 |
AB3C15D17 |
5.28 |
4.15 |
-9.12 |
-1.15 |
0 |
|
|
30801 |
841940 |
1 |
OSN3C18H21 |
ABC3D18E21 |
27.56 |
5.41 |
-8.36 |
-0.15 |
0 |
|
|
30802 |
841942 |
1 |
SCl2N3H11C13 |
AB2C3D11E13 |
53.38 |
2.93 |
-8.92 |
-1.1 |
0 |
|
|
30803 |
841943 |
1 |
NOC16H17 |
ABC16D17 |
-18.3 |
4.51 |
-8.62 |
-0.25 |
0 |
|
|
30804 |
841946 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-135.67 |
2.34 |
-9.28 |
-0.4 |
0 |
|
|
30805 |
841951 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-31.01 |
6.43 |
-8.85 |
-0.49 |
0 |
|
|
30806 |
841952 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-31.01 |
6.48 |
-8.85 |
-0.47 |
0 |
|
|
30807 |
841954 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-90.63 |
7.0 |
-8.6 |
-0.5 |
0 |
|
|
30808 |
841955 |
2 |
ON2C9H11 |
AB2C9D11 |
-23.06 |
6.36 |
-8.79 |
-0.48 |
0 |
|
|
30809 |
841956 |
2 |
ON2C9H11 |
AB2C9D11 |
-21.77 |
10.45 |
-8.83 |
-0.48 |
0 |
|
|
30810 |
841957 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-16.64 |
5.65 |
-8.87 |
-0.54 |
0 |
|
|
30811 |
841958 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-16.73 |
6.08 |
-8.88 |
-0.53 |
0 |
|
|
30812 |
841959 |
2 |
ON2C8H9 |
AB2C8D9 |
-9.31 |
6.16 |
-8.78 |
-0.55 |
0 |
|
|
30813 |
841960 |
2 |
ON2C8H9 |
AB2C8D9 |
-8.33 |
10.01 |
-8.84 |
-0.53 |
0 |
|
|
30814 |
841961 |
1 |
NO2H17C19 |
AB2C17D19 |
-26.88 |
2.0 |
-9.09 |
-1.17 |
0 |
|
|
30815 |
841964 |
1 |
FNOSCl2H8C15 |
ABCDE2F8G15 |
-39.1 |
3.25 |
-9.17 |
-1.72 |
0 |
|
|
30816 |
841965 |
1 |
NO5H17C18 |
AB5C17D18 |
-148.22 |
2.66 |
-8.79 |
-0.94 |
0 |
|
|
30817 |
841966 |
1 |
OF2N5H15C16 |
AB2C5D15E16 |
-45.95 |
3.5 |
-8.6 |
-1.83 |
0 |
|
|
30818 |
841967 |
1 |
NOSC18H21 |
ABCD18E21 |
-19.31 |
2.3 |
-8.97 |
-0.44 |
0 |
|
|
30819 |
841968 |
1 |
NOSC18H21 |
ABCD18E21 |
-19.83 |
2.66 |
-8.98 |
-0.39 |
0 |
|
|
30820 |
841969 |
1 |
OSCl2N3H11C14 |
ABC2D3E11F14 |
23.64 |
6.08 |
-9.01 |
-1.34 |
0 |
|
|
30821 |
841971 |
1 |
ON2S2C18H20 |
AB2C2D18E20 |
9.61 |
5.96 |
-9.01 |
-0.72 |
0 |
|
|
30822 |
841972 |
1 |
NOSC19H19 |
ABCD19E19 |
-1.36 |
3.34 |
-8.83 |
-0.71 |
0 |