List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
322734 |
126670934 |
1 |
ON5C20H27 |
AB5C20D27 |
-1.52 |
4.47 |
-8.54 |
-0.57 |
0 |
|
|
322735 |
126670935 |
1 |
NF2O4C15H25 |
AB2C4D15E25 |
-322.37 |
4.37 |
-10.07 |
0.1 |
0 |
|
|
322736 |
126670936 |
1 |
NO4C13H17 |
AB4C13D17 |
-93.56 |
6.03 |
-9.33 |
-0.74 |
0 |
|
|
322737 |
126670937 |
1 |
BrN2O3C15H17 |
AB2C3D15E17 |
-100.46 |
8.71 |
-8.97 |
-0.66 |
0 |
|
|
322738 |
126670949 |
1 |
ClO3N6H29C30 |
AB3C6D29E30 |
2.06 |
9.09 |
-8.91 |
-0.77 |
0 |
|
|
322739 |
126670950 |
2 |
IOH3C4 |
ABC3D4 |
-32.63 |
5.27 |
-9.68 |
-1.72 |
0 |
|
|
322740 |
126670951 |
1 |
O2N3H15C18 |
A2B3C15D18 |
1.85 |
1.52 |
-8.77 |
-0.64 |
0 |
|
|
322741 |
126670952 |
1 |
NC10H17 |
AB10C17 |
12.09 |
1.93 |
-9.34 |
2.67 |
0 |
|
|
322742 |
126670954 |
1 |
ON6C14H18 |
AB6C14D18 |
19.48 |
1.23 |
-8.88 |
-0.53 |
0 |
|
|
322743 |
126670957 |
1 |
ClC6H11 |
AB6C11 |
-38.61 |
2.53 |
-10.47 |
1.04 |
0 |
|
|
322744 |
126670959 |
1 |
ClC6H11 |
AB6C11 |
-37.62 |
2.32 |
-10.39 |
1.11 |
0 |
|
|
322745 |
126670960 |
1 |
OC7H14 |
AB7C14 |
-64.35 |
1.46 |
-9.59 |
2.36 |
0 |
|
|
322746 |
126670961 |
1 |
OC7H14 |
AB7C14 |
-77.3 |
2.31 |
-10.23 |
2.9 |
0 |
|
|
322747 |
126670963 |
2 |
ON4C17H25 |
AB4C17D25 |
-4.93 |
2.16 |
-8.24 |
-0.02 |
0 |
|
|
322748 |
126670965 |
1 |
BrNC9H12 |
ABC9D12 |
1.47 |
3.65 |
-9.47 |
-0.3 |
0 |
|
|
322749 |
126670980 |
1 |
BrNOC8H10 |
ABCD8E10 |
-34.28 |
1.78 |
-9.78 |
-0.6 |
0 |
|
|
322750 |
126670981 |
1 |
BrN2F3C7H8 |
AB2C3D7E8 |
-126.02 |
2.1 |
-9.55 |
-0.3 |
0 |
|
|
322751 |
126670995 |
1 |
ClSN2H9C10 |
ABC2D9E10 |
54.54 |
1.72 |
-9.37 |
-0.82 |
0 |
|
|
322752 |
126670996 |
1 |
ClSN2H9C10 |
ABC2D9E10 |
59.5 |
3.07 |
-9.57 |
-1.25 |
0 |
|
|
322753 |
126671000 |
1 |
ClSN2H9C10 |
ABC2D9E10 |
50.98 |
2.69 |
-9.34 |
-1.04 |
0 |
|
|
322754 |
126671001 |
2 |
NC6H7 |
AB6C7 |
50.39 |
3.01 |
-9.24 |
-0.16 |
0 |
|
|
322755 |
126671010 |
1 |
N3C11H13 |
A3B11C13 |
45.46 |
1.25 |
-8.47 |
-0.67 |
0 |
|
|
322756 |
126671030 |
1 |
ISF2O2H9C10 |
ABC2D2E9F10 |
-143.52 |
5.44 |
-10.11 |
-2.01 |
0 |
|
|
322757 |
126671037 |
1 |
OC10H18 |
AB10C18 |
-79.66 |
3.81 |
-9.82 |
0.82 |
0 |
|
|
322758 |
126671038 |
1 |
FC10H19 |
AB10C19 |
-95.9 |
2.11 |
-10.65 |
3.22 |
0 |
|
|
322759 |
126671039 |
1 |
FC8H15 |
AB8C15 |
-89.46 |
2.2 |
-10.82 |
3.12 |
0 |
|
|
322760 |
126671040 |
1 |
OC10H18 |
AB10C18 |
-76.15 |
3.47 |
-9.69 |
0.82 |
0 |
|
|
322761 |
126671043 |
1 |
BrFO3N6H20C21 |
ABC3D6E20F21 |
-98.47 |
2.34 |
-8.96 |
-0.8 |
0 |
|
|
322762 |
126671044 |
1 |
FC8H15 |
AB8C15 |
-85.37 |
1.68 |
-10.66 |
3.5 |
0 |
|
|
322763 |
126671045 |
1 |
BrO3N6C23H23 |
AB3C6D23E23 |
-43.2 |
5.27 |
-8.83 |
-0.66 |
0 |
|
|
322764 |
126671046 |
1 |
NSO2C10H19 |
ABC2D10E19 |
-126.66 |
3.61 |
-8.88 |
0.14 |
0 |
|
|
322765 |
126671050 |
1 |
FC6H11 |
AB6C11 |
-75.07 |
1.7 |
-11.2 |
3.32 |
0 |
|
|
322766 |
126671061 |
1 |
FOC8H15 |
ABC8D15 |
-127.48 |
1.79 |
-10.3 |
2.5 |
0 |
|
|
322767 |
126671063 |
1 |
FOC8H15 |
ABC8D15 |
-125.27 |
2.67 |
-10.33 |
2.44 |
0 |
|
|
322768 |
126671064 |
1 |
FOC10H19 |
ABC10D19 |
-135.78 |
3.58 |
-10.21 |
2.65 |
0 |
|
|
322769 |
126671065 |
1 |
FOC8H15 |
ABC8D15 |
-130.62 |
2.4 |
-10.41 |
2.39 |
0 |
|
|
322770 |
126671066 |
1 |
NOC10H19 |
ABC10D19 |
-58.56 |
4.05 |
-9.31 |
1.42 |
0 |
|
|
322771 |
126671067 |
1 |
FC8H15 |
AB8C15 |
-87.34 |
1.97 |
-10.71 |
3.42 |
0 |
|
|
322772 |
126671068 |
1 |
FC10H19 |
AB10C19 |
-94.23 |
1.97 |
-10.57 |
3.42 |
0 |
|
|
322773 |
126671069 |
1 |
FOC9H17 |
ABC9D17 |
-121.62 |
3.07 |
-9.68 |
2.06 |
0 |
|
|
322774 |
126671070 |
1 |
FOC9H17 |
ABC9D17 |
-122.66 |
1.28 |
-9.65 |
2.14 |
0 |
|
|
322775 |
126671072 |
1 |
FOC11H21 |
ABC11D21 |
-130.72 |
3.24 |
-9.63 |
2.09 |
0 |
|
|
322776 |
126671075 |
1 |
FOC8H15 |
ABC8D15 |
-128.62 |
2.42 |
-10.35 |
2.5 |
0 |
|
|
322777 |
126671080 |
1 |
FOC10H19 |
ABC10D19 |
-135.15 |
0.55 |
-10.4 |
2.29 |
0 |
|
|
322778 |
126671083 |
1 |
FOC9H17 |
ABC9D17 |
-123.92 |
0.9 |
-9.85 |
1.89 |
0 |
|
|
322779 |
126671084 |
1 |
FO4N5C22H22 |
AB4C5D22E22 |
-106.32 |
4.74 |
-8.78 |
-1.43 |
0 |
|
|
322780 |
126671085 |
1 |
FOC10H19 |
ABC10D19 |
-137.95 |
3.73 |
-10.2 |
2.7 |
0 |
|
|
322781 |
126671086 |
1 |
FOC11H21 |
ABC11D21 |
-130.63 |
2.77 |
-9.66 |
2.15 |
0 |
|
|
322782 |
126671087 |
1 |
INC7H12 |
ABC7D12 |
18.53 |
2.23 |
-8.52 |
-1.32 |
0 |
|
|
322783 |
126671088 |
1 |
FOC8H15 |
ABC8D15 |
-127.6 |
2.82 |
-10.33 |
2.45 |
0 |
|
|
322784 |
126671106 |
1 |
NO2C12H27 |
AB2C12D27 |
-112.54 |
2.29 |
-9.75 |
1.63 |
0 |
|
|
322785 |
126671114 |
1 |
SN4O4C28H36 |
AB4C4D28E36 |
-108.87 |
3.21 |
-9.19 |
-0.77 |
0 |
|
|
322786 |
126671124 |
1 |
O3N7C43H43 |
A3B7C43D43 |
80.83 |
5.11 |
-8.57 |
-0.97 |
0 |
|
|
322787 |
126671126 |
1 |
O3N7C38H51 |
A3B7C38D51 |
2.02 |
4.26 |
-8.78 |
-0.3 |
0 |
|
|
322788 |
126671127 |
1 |
O3N7C37H49 |
A3B7C37D49 |
9.68 |
6.4 |
-8.85 |
-0.4 |
0 |
|
|
322789 |
126671128 |
1 |
O3N7C38H41 |
A3B7C38D41 |
43.17 |
5.81 |
-8.37 |
-0.8 |
0 |
|
|
322790 |
126671130 |
1 |
FO3N7C35H42 |
AB3C7D35E42 |
-18.08 |
9.8 |
-8.18 |
-0.41 |
0 |
|
|
322791 |
126671131 |
1 |
O3N7C39H45 |
A3B7C39D45 |
47.35 |
6.7 |
-8.89 |
-0.44 |
0 |
|
|
322792 |
126671133 |
1 |
PN4O9C15H19 |
AB4C9D15E19 |
-289.89 |
7.95 |
-9.52 |
-1.75 |
0 |
|
|
322793 |
126671138 |
1 |
O3N7C37H39 |
A3B7C37D39 |
59.3 |
5.04 |
-8.51 |
-0.9 |
0 |
|
|
322794 |
126671144 |
1 |
BrO4N7C30H30 |
AB4C7D30E30 |
-18.48 |
7.11 |
-9.05 |
-0.91 |
0 |
|
|
322795 |
126671148 |
1 |
F3O3N8H25C28 |
A3B3C8D25E28 |
-119.32 |
3.04 |
-9.36 |
-1.39 |
0 |
|
|
322796 |
126671166 |
1 |
OF6C16H20 |
AB6C16D20 |
-373.36 |
6.06 |
-10.02 |
-0.6 |
0 |
|
|
322797 |
126671174 |
1 |
ClN3O4C25H34 |
AB3C4D25E34 |
-152.43 |
2.5 |
-9.68 |
-0.53 |
0 |
|
|
322798 |
126671180 |
1 |
ON3C32H59 |
AB3C32D59 |
-116.43 |
1.08 |
-8.68 |
0.48 |
0 |
|
|
322799 |
126671182 |
2 |
NOC18H30 |
ABC18D30 |
-137.83 |
2.29 |
-8.58 |
0.52 |
0 |
|
|
322800 |
126671183 |
1 |
NO2C20H29 |
AB2C20D29 |
-76.34 |
2.56 |
-8.35 |
0.01 |
0 |
|
|
322801 |
126671184 |
1 |
NO2C19H29 |
AB2C19D29 |
-87.22 |
2.59 |
-8.25 |
0.11 |
0 |
|
|
322802 |
126671194 |
1 |
N4O4C31H64 |
A4B4C31D64 |
-250.32 |
3.72 |
-8.14 |
1.88 |
0 |
|
|
322803 |
126671199 |
1 |
ON2C25H34 |
AB2C25D34 |
-16.45 |
1.31 |
-8.21 |
0.07 |
0 |
|
|
322804 |
126671202 |
1 |
NO2C24H31 |
AB2C24D31 |
-60.59 |
2.72 |
-8.45 |
0.1 |
0 |
|
|
322805 |
126671208 |
1 |
ClN7O10C58H68 |
AB7C10D58E68 |
-292.16 |
6.68 |
-8.66 |
-1.08 |
0 |
|
|
322806 |
126671210 |
1 |
NOC14H21 |
ABC14D21 |
-41.03 |
3.19 |
-8.96 |
0.42 |
0 |
|
|
322807 |
126671211 |
1 |
NC26H31 |
AB26C31 |
111.87 |
0.49 |
-7.98 |
0.08 |
0 |
|
|
322808 |
126671216 |
1 |
ClSO6N10C46H55 |
ABC6D10E46F55 |
-155.69 |
8.18 |
-9.14 |
-0.74 |
0 |
|
|
322809 |
126671219 |
1 |
ClS2O8N9C57H68 |
AB2C8D9E57F68 |
-213.54 |
7.74 |
-8.2 |
-1.46 |
0 |
|
|
322810 |
126671222 |
1 |
N4O4C29H46 |
A4B4C29D46 |
-189.41 |
7.21 |
-8.91 |
-0.16 |
0 |
|
|
322811 |
126671228 |
1 |
S2O8N9C57H67 |
A2B8C9D57E67 |
-185.1 |
10.69 |
-8.17 |
-1.4 |
0 |
|
|
322812 |
126671239 |
1 |
SN7O9C55H63 |
AB7C9D55E63 |
-225.0 |
14.14 |
-8.27 |
-1.0 |
0 |
|
|
322813 |
126671240 |
1 |
ClS2O7N9C49H58 |
AB2C7D9E49F58 |
-180.01 |
8.9 |
-9.32 |
-1.55 |
0 |
|
|
322814 |
126671242 |
1 |
ClS2O7N9C52H58 |
AB2C7D9E52F58 |
-165.79 |
6.09 |
-8.57 |
-1.25 |
0 |
|
|
322815 |
126671247 |
1 |
FOC7H13 |
ABC7D13 |
-126.6 |
2.53 |
-10.5 |
2.36 |
0 |
|
|
322816 |
126671255 |
1 |
ClS2O6N9C54H60 |
AB2C6D9E54F60 |
-120.4 |
14.92 |
-8.98 |
-1.52 |
0 |
|
|
322817 |
126671260 |
2 |
F3H4C7 |
A3B4C7 |
-232.11 |
3.2 |
-9.86 |
-1.18 |
0 |
|
|
322818 |
126671261 |
1 |
BrNC8H10 |
ABC8D10 |
1.81 |
3.86 |
-9.74 |
-0.31 |
0 |
|
|
322819 |
126671262 |
1 |
ClFSH10C12 |
ABCD10E12 |
-17.0 |
1.25 |
-9.03 |
-0.82 |
0 |
|
|
322820 |
126671263 |
1 |
ClFS2O6N9C54H59 |
ABC2D6E9F54G59 |
-171.37 |
11.74 |
-9.04 |
-1.6 |
0 |
|
|
322821 |
126671265 |
1 |
SF2O2H12C14 |
AB2C2D12E14 |
-139.98 |
5.2 |
-9.74 |
-0.76 |
0 |
|
|
322822 |
126671266 |
1 |
ClSN2H7C9 |
ABC2D7E9 |
53.86 |
1.59 |
-9.22 |
-1.23 |
0 |
|
|
322823 |
126671269 |
1 |
ClFS2O7N9C50H53 |
ABC2D7E9F50G53 |
-187.17 |
10.8 |
-9.1 |
-1.63 |
0 |
|
|
322824 |
126671270 |
1 |
NO2C13H17 |
AB2C13D17 |
-45.94 |
4.48 |
-9.0 |
-0.26 |
0 |
|
|
322825 |
126671272 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-93.59 |
2.32 |
-8.86 |
-0.46 |
0 |
|
|
322826 |
126671273 |
1 |
NO3C12H17 |
AB3C12D17 |
-101.38 |
3.91 |
-8.44 |
0.43 |
0 |
|
|
322827 |
126671277 |
1 |
NO4C15H23 |
AB4C15D23 |
-150.03 |
2.02 |
-8.36 |
0.46 |
0 |
|
|
322828 |
126671278 |
1 |
NO3C17H19 |
AB3C17D19 |
-72.67 |
4.86 |
-8.53 |
-0.26 |
0 |
|
|
322829 |
126671281 |
1 |
NO2C14H17 |
AB2C14D17 |
-50.64 |
3.74 |
-8.94 |
-0.37 |
0 |
|
|
322830 |
126671283 |
1 |
SN2O2C15H24 |
AB2C2D15E24 |
-66.4 |
4.51 |
-9.18 |
-0.67 |
0 |
|
|
322831 |
126671284 |
1 |
NSO2C15H23 |
ABC2D15E23 |
-82.68 |
4.28 |
-8.88 |
0.26 |
0 |
|
|
322832 |
126671285 |
2 |
NOC7H11 |
ABC7D11 |
-67.2 |
5.74 |
-9.17 |
-0.65 |
0 |
|
|
322833 |
126671286 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-115.98 |
2.17 |
-8.16 |
-0.07 |
0 |