List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
432722 |
135172859 |
1 |
FN5O8C45H74 |
AB5C8D45E74 |
-451.58 |
6.85 |
-8.91 |
-0.39 |
0 |
|
|
432723 |
135172860 |
1 |
N2O4H18C21 |
A2B4C18D21 |
-81.03 |
3.6 |
-9.28 |
-1.46 |
0 |
|
|
432724 |
135172861 |
1 |
N2O6H26C29 |
A2B6C26D29 |
-159.06 |
6.88 |
-9.12 |
-0.68 |
0 |
|
|
432725 |
135172862 |
1 |
SN5O8C39H65 |
AB5C8D39E65 |
-361.32 |
5.47 |
-9.12 |
-0.18 |
0 |
|
|
432726 |
135172863 |
1 |
N5O10C59H83 |
A5B10C59D83 |
-422.35 |
7.47 |
-8.72 |
-0.27 |
0 |
|
|
432727 |
135172864 |
1 |
ClC16H27 |
AB16C27 |
-30.57 |
2.51 |
-8.63 |
0.53 |
0 |
|
|
432728 |
135172865 |
2 |
O3C8H12 |
A3B8C12 |
-280.84 |
5.96 |
-10.33 |
-0.18 |
0 |
|
|
432729 |
135172866 |
1 |
ON2C16H26 |
AB2C16D26 |
-58.65 |
1.4 |
-8.02 |
0.49 |
0 |
|
|
432730 |
135172867 |
1 |
FN5O8C39H66 |
AB5C8D39E66 |
-456.32 |
3.73 |
-8.9 |
0.12 |
0 |
|
|
432731 |
135172868 |
1 |
FN2O4C19H27 |
AB2C4D19E27 |
-215.21 |
2.75 |
-9.33 |
0.12 |
0 |
|
|
432732 |
135172869 |
2 |
ON2C14H17 |
AB2C14D17 |
-21.68 |
3.24 |
-8.65 |
-0.46 |
0 |
|
|
432733 |
135172870 |
1 |
N3O4C23H27 |
A3B4C23D27 |
-106.01 |
3.04 |
-9.15 |
-0.75 |
0 |
|
|
432734 |
135172871 |
2 |
O4C18H23 |
A4B18C23 |
-321.26 |
4.18 |
-8.4 |
-0.56 |
0 |
|
|
432735 |
135172872 |
1 |
FSN7O11C50H80 |
ABC7D11E50F80 |
-590.11 |
6.18 |
-8.97 |
-0.21 |
0 |
|
|
432736 |
135172873 |
1 |
O3N7H23C24 |
A3B7C23D24 |
25.81 |
8.88 |
-9.07 |
-0.89 |
0 |
|
|
432737 |
135172874 |
1 |
O2N4C25H28 |
A2B4C25D28 |
-5.26 |
6.58 |
-8.69 |
-0.52 |
0 |
|
|
432738 |
135172875 |
2 |
N2O2C15H18 |
A2B2C15D18 |
-117.47 |
6.98 |
-8.73 |
-0.63 |
0 |
|
|
432739 |
135172876 |
1 |
BrNO2H8C9 |
ABC2D8E9 |
-53.91 |
3.03 |
-9.95 |
-1.11 |
0 |
|
|
432740 |
135172877 |
1 |
O2F3N4C27H29 |
A2B3C4D27E29 |
-169.81 |
6.57 |
-8.89 |
-0.78 |
0 |
|
|
432741 |
135172878 |
1 |
SN7O12C48H77 |
AB7C12D48E77 |
-559.8 |
5.63 |
-9.19 |
-0.45 |
0 |
|
|
432742 |
135172879 |
1 |
NOSCl2H7C8 |
ABCD2E7F8 |
-27.4 |
3.96 |
-8.67 |
-0.98 |
0 |
|
|
432743 |
135172880 |
1 |
SN7O11C52H83 |
AB7C11D52E83 |
-526.84 |
6.86 |
-9.14 |
-0.43 |
0 |
|
|
432744 |
135172881 |
2 |
NO3C18H20 |
AB3C18D20 |
-190.14 |
4.78 |
-9.07 |
-0.6 |
0 |
|
|
432745 |
135172882 |
1 |
F2O7N9C46H57 |
A2B7C9D46E57 |
-346.75 |
6.27 |
-8.8 |
-0.33 |
0 |
|
|
432746 |
135172883 |
1 |
F2N10O15C57H76 |
A2B10C15D57E76 |
-713.39 |
11.54 |
-9.01 |
-1.35 |
0 |
|
|
432747 |
135172884 |
1 |
N3O6H33C34 |
A3B6C33D34 |
-98.49 |
7.37 |
-8.92 |
-0.71 |
0 |
|
|
432748 |
135172885 |
1 |
O2N8C25H26 |
A2B8C25D26 |
59.57 |
2.14 |
-8.86 |
-1.04 |
0 |
|
|
432749 |
135172886 |
1 |
N2O6C35H38 |
A2B6C35D38 |
-198.97 |
6.21 |
-8.84 |
-0.56 |
0 |
|
|
432750 |
135172887 |
1 |
F2N7O10C54H63 |
A2B7C10D54E63 |
-453.08 |
9.12 |
-8.71 |
-0.43 |
0 |
|
|
432751 |
135172888 |
1 |
N3O6C34H37 |
A3B6C34D37 |
-155.34 |
7.52 |
-8.89 |
-0.68 |
0 |
|
|
432752 |
135172889 |
1 |
N2O6H30C31 |
A2B6C30D31 |
-165.46 |
8.04 |
-9.06 |
-0.66 |
0 |
|
|
432753 |
135172890 |
1 |
N2O6C31H34 |
A2B6C31D34 |
-222.33 |
5.32 |
-9.04 |
-0.59 |
0 |
|
|
432754 |
135172891 |
2 |
NO3H12C16 |
AB3C12D16 |
-115.44 |
0.69 |
-9.08 |
-0.58 |
0 |
|
|
432755 |
135172892 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-179.3 |
5.66 |
-9.73 |
-0.31 |
0 |
|
|
432756 |
135172893 |
1 |
N4O7C17H22 |
A4B7C17D22 |
-295.15 |
6.01 |
-9.52 |
-0.15 |
0 |
|
|
432757 |
135172894 |
1 |
NO2C17H35 |
AB2C17D35 |
-159.99 |
2.91 |
-9.67 |
1.11 |
0 |
|
|
432758 |
135172895 |
1 |
F2N8O15C53H68 |
A2B8C15D53E68 |
-702.09 |
12.25 |
-8.86 |
-0.97 |
0 |
|
|
432759 |
135172896 |
1 |
NO4H11C12 |
AB4C11D12 |
-124.99 |
4.01 |
-9.37 |
-0.62 |
0 |
|
|
432760 |
135172897 |
2 |
NO3H14C15 |
AB3C14D15 |
-160.03 |
4.91 |
-9.12 |
-0.64 |
0 |
|
|
432761 |
135172898 |
2 |
NO3H10C13 |
AB3C10D13 |
-140.1 |
0.11 |
-9.08 |
-0.69 |
0 |
|
|
432762 |
135172899 |
1 |
N2O6H22C27 |
A2B6C22D27 |
-144.33 |
4.51 |
-9.1 |
-0.64 |
0 |
|
|
432763 |
135172900 |
1 |
N6O11C51H76 |
A6B11C51D76 |
-429.68 |
7.84 |
-9.11 |
-1.66 |
0 |
|
|
432764 |
135172901 |
1 |
N2O8H34C35 |
A2B8C34D35 |
-239.15 |
7.96 |
-8.88 |
-0.56 |
0 |
|
|
432765 |
135172902 |
1 |
N5O10C59H85 |
A5B10C59D85 |
-472.6 |
2.76 |
-8.89 |
-0.44 |
0 |
|
|
432766 |
135172903 |
1 |
N5C18H23 |
A5B18C23 |
115.58 |
5.71 |
-7.91 |
-0.52 |
0 |
|
|
432767 |
135172904 |
1 |
FN4O6C24H35 |
AB4C6D24E35 |
-281.83 |
3.22 |
-9.29 |
-0.36 |
0 |
|
|
432768 |
135172905 |
2 |
O2H32C41 |
A2B32C41 |
150.84 |
4.66 |
-8.37 |
-0.21 |
0 |
|
|
432769 |
135172906 |
2 |
O3C7H10 |
A3B7C10 |
-252.04 |
6.05 |
-10.73 |
-0.56 |
0 |
|
|
432770 |
135172907 |
1 |
FN3O5C27H34 |
AB3C5D27E34 |
-208.92 |
6.44 |
-9.3 |
-0.44 |
0 |
|
|
432771 |
135172908 |
1 |
NF2C23H25 |
AB2C23D25 |
-55.33 |
3.79 |
-8.54 |
-0.22 |
0 |
|
|
432772 |
135172909 |
1 |
O6H114C137 |
A6B114C137 |
413.34 |
4.2 |
-7.98 |
-0.63 |
0 |
|
|
432773 |
135172910 |
1 |
ON5C19H23 |
AB5C19D23 |
90.79 |
2.98 |
-7.87 |
-0.55 |
1 |
|
|
432774 |
135172911 |
1 |
O3N6C21H23 |
A3B6C21D23 |
-19.44 |
11.75 |
0.0 |
0.0 |
1 |
|
|
432775 |
135172912 |
1 |
ON5C17H20 |
AB5C17D20 |
60.35 |
2.48 |
0.0 |
0.0 |
1 |
|
|
432776 |
135172913 |
1 |
N6C21H29 |
A6B21C29 |
101.58 |
4.04 |
0.0 |
0.0 |
1 |
|
|
432777 |
135172914 |
1 |
ON6C18H19 |
AB6C18D19 |
122.56 |
4.99 |
0.0 |
0.0 |
0 |
|
|
432778 |
135172915 |
1 |
O2N5C18H21 |
A2B5C18D21 |
31.0 |
3.39 |
-8.23 |
-1.05 |
1 |
|
|
432779 |
135172916 |
1 |
N6C17H21 |
A6B17C21 |
90.96 |
1.67 |
0.0 |
0.0 |
0 |
|
|
432780 |
135172917 |
5 |
NC4H5 |
AB4C5 |
119.09 |
1.85 |
-8.01 |
-0.88 |
1 |
|
|
432781 |
135172918 |
1 |
ON4H17C19 |
AB4C17D19 |
77.28 |
4.61 |
0.0 |
0.0 |
1 |
|
|
432782 |
135172919 |
1 |
O2N6C21H27 |
A2B6C21D27 |
28.64 |
6.03 |
0.0 |
0.0 |
1 |
|
|
432783 |
135172920 |
1 |
Cl2N7C19H20 |
A2B7C19D20 |
147.72 |
6.89 |
0.0 |
0.0 |
0 |
|
|
432784 |
135172921 |
2 |
NO3H14C16 |
AB3C14D16 |
-123.45 |
3.87 |
-8.91 |
-0.69 |
0 |
|
|
432785 |
135172922 |
2 |
NO3H14C16 |
AB3C14D16 |
-118.3 |
9.18 |
-8.82 |
-0.63 |
0 |
|
|
432786 |
135172923 |
2 |
NO4H14C15 |
AB4C14D15 |
-220.58 |
7.12 |
-9.11 |
-0.63 |
0 |
|
|
432787 |
135172924 |
1 |
N3O7C31H31 |
A3B7C31D31 |
-182.93 |
11.17 |
-8.88 |
-0.74 |
1 |
|
|
432788 |
135172925 |
1 |
ON6H19C21 |
AB6C19D21 |
129.34 |
6.57 |
0.0 |
0.0 |
0 |
|
|
432789 |
135172926 |
2 |
O2H29C42 |
A2B29C42 |
159.77 |
0.88 |
-8.6 |
-0.35 |
0 |
|
|
432790 |
135172927 |
2 |
OH21C30 |
AB21C30 |
140.53 |
0.88 |
-8.71 |
-0.54 |
0 |
|
|
432791 |
135172928 |
2 |
O3H47C66 |
A3B47C66 |
318.61 |
2.97 |
-8.7 |
-0.39 |
0 |
|
|
432792 |
135172929 |
1 |
OH42C60 |
AB42C60 |
196.96 |
1.2 |
-8.77 |
-0.34 |
0 |
|
|
432793 |
135172930 |
2 |
O2H27C39 |
A2B27C39 |
136.31 |
3.68 |
-8.59 |
-0.38 |
0 |
|
|
432794 |
135172931 |
2 |
O2H29C43 |
A2B29C43 |
177.51 |
3.38 |
-8.07 |
-0.9 |
0 |
|
|
432795 |
135172932 |
2 |
O2H23C33 |
A2B23C33 |
83.75 |
1.91 |
-8.66 |
-0.4 |
0 |
|
|
432796 |
135172933 |
2 |
OH31C42 |
AB31C42 |
199.17 |
2.47 |
-8.38 |
-0.62 |
0 |