List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
272800 |
103759267 |
1 |
NO4C26H33 |
AB4C26D33 |
-162.61 |
4.61 |
-8.95 |
-0.51 |
0 |
|
|
272801 |
103759327 |
1 |
N3O3C17H29 |
A3B3C17D29 |
-121.42 |
2.0 |
-8.9 |
0.64 |
0 |
|
|
272802 |
103759328 |
1 |
ClN2O2C17H25 |
AB2C2D17E25 |
-105.13 |
2.03 |
-9.28 |
-0.1 |
0 |
|
|
272803 |
103759329 |
2 |
NOC9H14 |
ABC9D14 |
-102.04 |
2.27 |
-9.09 |
0.34 |
0 |
|
|
272804 |
103759398 |
1 |
SN3O4C15H23 |
AB3C4D15E23 |
-165.39 |
8.61 |
-9.16 |
-0.61 |
0 |
|
|
272805 |
103759399 |
1 |
N3O3C16H31 |
A3B3C16D31 |
-157.93 |
5.05 |
-8.63 |
0.9 |
0 |
|
|
272806 |
103759400 |
1 |
O2N3C18H29 |
A2B3C18D29 |
-95.65 |
3.43 |
-7.87 |
0.45 |
0 |
|
|
272807 |
103759514 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-74.31 |
2.01 |
-8.12 |
0.01 |
0 |
|
|
272808 |
103759611 |
1 |
O2N3C17H35 |
A2B3C17D35 |
-133.21 |
3.44 |
-8.44 |
0.89 |
0 |
|
|
272809 |
103759654 |
1 |
N2O3C17H32 |
A2B3C17D32 |
-187.46 |
2.94 |
-8.92 |
0.97 |
0 |
|
|
272810 |
103759732 |
1 |
NSF2C8H11 |
ABC2D8E11 |
-80.11 |
2.5 |
-9.09 |
-0.28 |
0 |
|
|
272811 |
103759736 |
1 |
ClNF2C12H16 |
ABC2D12E16 |
-107.19 |
3.94 |
-9.28 |
-0.02 |
0 |
|
|
272812 |
103759738 |
1 |
NF3C11H14 |
AB3C11D14 |
-140.09 |
3.5 |
-9.35 |
0.05 |
0 |
|
|
272813 |
103759739 |
1 |
NF3C12H16 |
AB3C12D16 |
-144.98 |
3.69 |
-9.38 |
0.05 |
0 |
|
|
272814 |
103759743 |
1 |
NCl2F2C10H11 |
AB2C2D10E11 |
-107.89 |
2.4 |
-9.47 |
-0.56 |
0 |
|
|
272815 |
103759744 |
1 |
NCl2F2C11H13 |
AB2C2D11E13 |
-113.86 |
2.57 |
-9.36 |
-0.55 |
0 |
|
|
272816 |
103759747 |
1 |
NF2C18H21 |
AB2C18D21 |
-68.27 |
1.67 |
-9.28 |
0.15 |
0 |
|
|
272817 |
103759748 |
1 |
BrNF2C10H12 |
ABC2D10E12 |
-84.3 |
2.63 |
-9.46 |
-0.06 |
0 |
|
|
272818 |
103759801 |
1 |
NCl2F2C11H13 |
AB2C2D11E13 |
-108.64 |
3.57 |
-9.32 |
-0.35 |
0 |
|
|
272819 |
103759803 |
1 |
ClNF2C9H10 |
ABC2D9E10 |
-89.48 |
2.72 |
-9.58 |
-0.27 |
0 |
|
|
272820 |
103759905 |
1 |
NOC14H21 |
ABC14D21 |
-25.54 |
3.27 |
-9.59 |
1.03 |
0 |
|
|
272821 |
103759955 |
1 |
FNO2H14C16 |
ABC2D14E16 |
-50.32 |
2.63 |
-8.49 |
-0.96 |
0 |
|
|
272822 |
103759978 |
1 |
FNO3H14C16 |
ABC3D14E16 |
-90.21 |
3.51 |
-8.93 |
-1.03 |
0 |
|
|
272823 |
103760094 |
1 |
OSN2C14H14 |
ABC2D14E14 |
25.75 |
4.77 |
-9.18 |
-0.64 |
0 |
|
|
272824 |
103760095 |
2 |
NOC7H8 |
ABC7D8 |
-8.16 |
3.37 |
-9.21 |
-0.61 |
0 |
|
|
272825 |
103760117 |
1 |
NOC12H15 |
ABC12D15 |
-11.51 |
4.65 |
-9.06 |
-0.51 |
0 |
|
|
272826 |
103760246 |
1 |
FN2O2H9C12 |
AB2C2D9E12 |
-80.04 |
2.38 |
-10.2 |
-0.94 |
0 |
|
|
272827 |
103760434 |
1 |
NOC14H15 |
ABC14D15 |
8.99 |
5.03 |
-9.02 |
-0.47 |
0 |
|
|
272828 |
103760471 |
1 |
BrOF2N2H7C12 |
ABC2D2E7F12 |
-74.25 |
3.36 |
-9.54 |
-1.38 |
0 |
|
|
272829 |
103760630 |
1 |
FON2C14H17 |
ABC2D14E17 |
-44.77 |
2.89 |
-9.17 |
-0.79 |
0 |
|
|
272830 |
103760649 |
1 |
FON3C14H18 |
ABC3D14E18 |
-52.64 |
4.1 |
-9.18 |
-0.85 |
0 |
|
|
272831 |
103760657 |
1 |
FON2C16H21 |
ABC2D16E21 |
-25.85 |
4.03 |
-9.03 |
-0.7 |
0 |
|
|
272832 |
103760800 |
1 |
FON2C15H17 |
ABC2D15E17 |
-36.59 |
2.88 |
-9.21 |
-0.8 |
0 |
|
|
272833 |
103760905 |
1 |
NOC15H25 |
ABC15D25 |
-45.06 |
4.36 |
-9.58 |
1.11 |
0 |
|
|
272834 |
103761100 |
1 |
ClF2N2H9C14 |
AB2C2D9E14 |
-23.74 |
5.64 |
-8.78 |
-1.16 |
0 |
|
|
272835 |
103761113 |
2 |
NF2H4C7 |
AB2C4D7 |
-103.27 |
1.28 |
-9.63 |
-1.01 |
0 |
|
|
272836 |
103761606 |
1 |
ON2C13H20 |
AB2C13D20 |
-30.03 |
2.33 |
-8.52 |
0.35 |
0 |
|
|
272837 |
103761718 |
1 |
N3C14H23 |
A3B14C23 |
15.9 |
3.01 |
-9.07 |
-0.04 |
0 |
|
|
272838 |
103761720 |
1 |
ON2C14H18 |
AB2C14D18 |
12.97 |
2.78 |
-8.41 |
-0.21 |
0 |
|
|
272839 |
103761723 |
1 |
N5C14H19 |
A5B14C19 |
108.87 |
7.11 |
-9.44 |
-0.79 |
0 |
|
|
272840 |
103761767 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-29.33 |
3.02 |
-9.33 |
-0.81 |
0 |
|
|
272841 |
103761771 |
1 |
SN2O3C12H20 |
AB2C3D12E20 |
-106.76 |
5.96 |
-9.94 |
0.31 |
0 |
|
|
272842 |
103761890 |
1 |
ON4C13H18 |
AB4C13D18 |
23.76 |
2.2 |
-10.01 |
0.05 |
0 |
|
|
272843 |
103761891 |
1 |
NSO4C15H31 |
ABC4D15E31 |
-236.5 |
5.24 |
-9.79 |
0.34 |
0 |
|
|
272844 |
103761931 |
1 |
ClFNSO2C11H15 |
ABCDE2F11G15 |
-126.15 |
7.62 |
-9.2 |
-0.12 |
0 |
|
|
272845 |
103761947 |
1 |
ClFN2C14H14 |
ABC2D14E14 |
-3.57 |
1.94 |
-9.54 |
-0.49 |
0 |
|
|
272846 |
103761951 |
1 |
ClFNOC15H15 |
ABCDE15F15 |
-55.61 |
0.77 |
-9.61 |
-0.48 |
0 |
|
|
272847 |
103761952 |
1 |
ClFNO2C13H19 |
ABCD2E13F19 |
-136.39 |
2.06 |
-9.25 |
-0.29 |
0 |
|
|
272848 |
103762027 |
4 |
NC4H6 |
AB4C6 |
59.63 |
3.09 |
-8.74 |
-0.32 |
0 |
|
|
272849 |
103762167 |
1 |
N2S2O3C13H20 |
A2B2C3D13E20 |
-97.32 |
6.06 |
-9.55 |
-1.0 |
0 |
|
|
272850 |
103762230 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-171.55 |
4.19 |
-9.4 |
-0.28 |
0 |
|
|
272851 |
103762322 |
1 |
ClINOH11C12 |
ABCDE11F12 |
-0.12 |
3.7 |
-9.69 |
-1.4 |
0 |
|
|
272852 |
103762359 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-87.82 |
2.34 |
-8.93 |
-0.52 |
0 |
|
|
272853 |
103762360 |
1 |
NSO2F3H10C13 |
ABC2D3E10F13 |
-167.9 |
4.02 |
-9.51 |
-1.11 |
0 |
|
|
272854 |
103762361 |
1 |
SN2O3C12H12 |
AB2C3D12E12 |
-65.75 |
3.5 |
-9.37 |
-0.84 |
0 |
|
|
272855 |
103762363 |
1 |
NO3C15H21 |
AB3C15D21 |
-141.68 |
6.47 |
-9.05 |
-0.04 |
0 |
|
|
272856 |
103762364 |
1 |
SO2N3C11H11 |
AB2C3D11E11 |
-26.48 |
6.98 |
-9.41 |
-0.91 |
0 |
|
|
272857 |
103762382 |
1 |
NO4C14H21 |
AB4C14D21 |
-176.55 |
3.68 |
-9.15 |
-0.18 |
0 |
|
|
272858 |
103762396 |
1 |
ON3C13H21 |
AB3C13D21 |
-24.31 |
5.57 |
-9.59 |
0.17 |
0 |
|
|
272859 |
103762412 |
1 |
NSO3C11H19 |
ABC3D11E19 |
-122.51 |
3.49 |
-8.45 |
0.14 |
0 |
|
|
272860 |
103762413 |
1 |
ClSN2O3H11C12 |
ABC2D3E11F12 |
-6.24 |
6.62 |
-8.94 |
-1.6 |
0 |
|
|
272861 |
103762556 |
1 |
NO3C16H21 |
AB3C16D21 |
-107.6 |
3.52 |
-9.71 |
-0.08 |
0 |
|
|
272862 |
103762557 |
1 |
BrFNO3C13H15 |
ABCD3E13F15 |
-164.72 |
2.91 |
-10.07 |
-1.03 |
0 |
|
|
272863 |
103762560 |
1 |
NF2O4C14H17 |
AB2C4D14E17 |
-267.39 |
1.5 |
-9.78 |
-0.73 |
0 |
|
|
272864 |
103762571 |
1 |
NO4C13H19 |
AB4C13D19 |
-164.77 |
4.82 |
-9.56 |
-0.36 |
0 |
|
|
272865 |
103762574 |
1 |
ClN2O3C12H15 |
AB2C3D12E15 |
-115.93 |
4.18 |
-10.17 |
-1.02 |
0 |
|
|
272866 |
103762580 |
1 |
NO3C12H23 |
AB3C12D23 |
-177.12 |
3.2 |
-9.74 |
1.15 |
0 |
|
|
272867 |
103763046 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-33.36 |
7.13 |
-9.31 |
-0.64 |
0 |
|
|
272868 |
103763053 |
1 |
N2O2F3H7C12 |
A2B2C3D7E12 |
-169.21 |
5.95 |
-9.56 |
-1.26 |
0 |
|
|
272869 |
103763057 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-74.96 |
2.41 |
-8.8 |
-0.98 |
0 |
|
|
272870 |
103763164 |
1 |
ClINO3H13C14 |
ABCD3E13F14 |
-92.44 |
2.15 |
-9.28 |
-1.48 |
0 |
|
|
272871 |
103763165 |
1 |
ClINO3C15H17 |
ABCD3E15F17 |
-124.39 |
5.21 |
-9.03 |
-1.26 |
0 |
|
|
272872 |
103763166 |
1 |
ClINO3C15H17 |
ABCD3E15F17 |
-122.87 |
1.54 |
-9.26 |
-1.44 |
0 |
|
|
272873 |
103763167 |
1 |
ClINO3C13H15 |
ABCD3E13F15 |
-130.05 |
5.93 |
-9.41 |
-1.59 |
0 |
|
|
272874 |
103763251 |
1 |
BrClNOC17H17 |
ABCDE17F17 |
-25.54 |
3.07 |
-8.87 |
-1.05 |
0 |