List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
121762 |
50780516 |
1 |
FO2N3H14C17 |
AB2C3D14E17 |
-40.07 |
4.44 |
-9.44 |
-1.32 |
0 |
|
|
121763 |
50780546 |
1 |
O3N4C24H26 |
A3B4C24D26 |
-42.76 |
5.9 |
-8.46 |
-1.35 |
0 |
|
|
121764 |
50780628 |
1 |
O4N5C26H27 |
A4B5C26D27 |
-17.85 |
6.19 |
-8.17 |
-1.3 |
0 |
|
|
121765 |
50780629 |
1 |
ClO2N5H18C22 |
AB2C5D18E22 |
78.63 |
7.95 |
-9.06 |
-1.41 |
0 |
|
|
121766 |
50780630 |
1 |
ClO2N5H18C22 |
AB2C5D18E22 |
78.6 |
7.14 |
-8.84 |
-1.41 |
0 |
|
|
121767 |
50780808 |
1 |
SO3N4H16C19 |
AB3C4D16E19 |
-4.79 |
2.77 |
-8.62 |
-1.42 |
0 |
|
|
121768 |
50780839 |
1 |
O2N5C23H23 |
A2B5C23D23 |
47.53 |
5.09 |
-8.56 |
-1.36 |
0 |
|
|
121769 |
50781072 |
1 |
N2O5C23H26 |
A2B5C23D26 |
-187.76 |
3.63 |
-8.51 |
-0.86 |
0 |
|
|
121770 |
50781073 |
1 |
ClSO2N4C25H29 |
ABC2D4E25F29 |
-41.53 |
4.45 |
-8.73 |
-1.16 |
0 |
|
|
121771 |
50781088 |
1 |
O2N6C27H34 |
A2B6C27D34 |
-20.04 |
5.21 |
-8.29 |
-0.81 |
0 |
|
|
121772 |
50781089 |
1 |
O3N5C29H31 |
A3B5C29D31 |
-30.65 |
0.63 |
-8.4 |
-0.92 |
0 |
|
|
121773 |
50781090 |
1 |
O2N5C23H27 |
A2B5C23D27 |
-23.69 |
5.48 |
-8.4 |
-0.9 |
0 |
|
|
121774 |
50781091 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-91.06 |
3.77 |
-8.24 |
-0.77 |
0 |
|
|
121775 |
50781092 |
2 |
ON3C12H18 |
AB3C12D18 |
-62.83 |
2.92 |
-8.3 |
-0.8 |
0 |
|
|
121776 |
50781093 |
2 |
ON3C11H16 |
AB3C11D16 |
-50.14 |
2.04 |
-8.32 |
-0.83 |
0 |
|
|
121777 |
50781094 |
1 |
ClO2N5C21H22 |
AB2C5D21E22 |
-17.8 |
3.92 |
-8.51 |
-0.98 |
0 |
|
|
121778 |
50781095 |
1 |
ClO2N5C21H22 |
AB2C5D21E22 |
-17.87 |
3.86 |
-8.71 |
-1.14 |
0 |
|
|
121779 |
50781096 |
1 |
FO2N6C24H27 |
AB2C6D24E27 |
-45.47 |
3.04 |
-8.4 |
-0.9 |
0 |
|
|
121780 |
50781097 |
2 |
ON3C12H13 |
AB3C12D13 |
2.05 |
5.7 |
-8.25 |
-0.78 |
0 |
|
|
121781 |
50781098 |
1 |
O2N4C25H28 |
A2B4C25D28 |
-46.72 |
2.71 |
-8.32 |
-0.77 |
0 |
|
|
121782 |
50781099 |
1 |
FO2N5H24C26 |
AB2C5D24E26 |
-25.69 |
5.39 |
-8.42 |
-0.96 |
0 |
|
|
121783 |
50781100 |
1 |
O3N5C28H29 |
A3B5C28D29 |
-26.7 |
6.12 |
-8.49 |
-0.94 |
0 |
|
|
121784 |
50781168 |
1 |
O2N5C27H27 |
A2B5C27D27 |
7.53 |
4.88 |
-8.55 |
-0.99 |
0 |
|
|
121785 |
50781188 |
2 |
ON3C13H16 |
AB3C13D16 |
-17.81 |
3.38 |
-8.31 |
-0.84 |
0 |
|
|
121786 |
50781191 |
1 |
O2N5C25H31 |
A2B5C25D31 |
-30.51 |
5.07 |
-8.37 |
-0.88 |
0 |
|
|
121787 |
50781192 |
1 |
O2N5C28H29 |
A2B5C28D29 |
7.74 |
5.8 |
-8.43 |
-0.91 |
0 |
|
|
121788 |
50781193 |
1 |
O3N6C21H28 |
A3B6C21D28 |
-92.17 |
4.62 |
-8.26 |
-0.77 |
0 |
|
|
121789 |
50781194 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-56.67 |
3.3 |
-8.25 |
-0.79 |
0 |
|
|
121790 |
50781372 |
1 |
O2N6C25H32 |
A2B6C25D32 |
-14.93 |
2.93 |
-8.51 |
-0.96 |
0 |
|
|
121791 |
50781396 |
1 |
O2N5C28H29 |
A2B5C28D29 |
7.17 |
4.01 |
-8.78 |
-1.2 |
0 |
|
|
121792 |
50781397 |
1 |
FO2N5H26C27 |
AB2C5D26E27 |
-30.92 |
3.89 |
-8.59 |
-1.06 |
0 |
|
|
121793 |
50781441 |
1 |
FO2N5H26C27 |
AB2C5D26E27 |
-38.93 |
1.73 |
-8.54 |
-0.99 |
0 |
|
|
121794 |
50781442 |
1 |
O2N5C22H25 |
A2B5C22D25 |
-17.12 |
5.04 |
-8.37 |
-0.87 |
0 |
|
|
121795 |
50781717 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-147.55 |
6.12 |
-9.05 |
-0.4 |
0 |
|
|
121796 |
50781774 |
1 |
ClO3N4C24H25 |
AB3C4D24E25 |
-81.99 |
11.66 |
-8.38 |
-0.72 |
0 |
|
|
121797 |
50781902 |
1 |
N4O4C21H32 |
A4B4C21D32 |
-165.02 |
6.8 |
-8.37 |
-0.52 |
0 |
|
|
121798 |
50781903 |
1 |
FN4O4C23H27 |
AB4C4D23E27 |
-179.14 |
1.8 |
-8.9 |
-0.82 |
0 |
|
|
121799 |
50781904 |
1 |
ClN4O4C24H29 |
AB4C4D24E29 |
-148.66 |
3.93 |
-8.93 |
-1.28 |
0 |
|
|
121800 |
50781947 |
1 |
FN4O5C24H29 |
AB4C5D24E29 |
-214.74 |
2.86 |
-8.34 |
-0.93 |
0 |
|
|
121801 |
50781948 |
1 |
FN4O5C23H27 |
AB4C5D23E27 |
-204.7 |
2.02 |
-8.93 |
-1.07 |
0 |
|
|
121802 |
50781949 |
1 |
ClN3O3H24C25 |
AB3C3D24E25 |
-57.99 |
6.47 |
-8.56 |
-0.51 |
0 |
|
|
121803 |
50781950 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-64.09 |
2.35 |
-8.32 |
-0.97 |
0 |
|
|
121804 |
50781951 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-93.38 |
1.53 |
-8.09 |
-0.8 |
0 |
|
|
121805 |
50781960 |
1 |
ClN3O3C21H24 |
AB3C3D21E24 |
-99.22 |
3.49 |
-8.37 |
-0.88 |
0 |
|
|
121806 |
50781963 |
1 |
ClN3O3C24H28 |
AB3C3D24E28 |
-95.78 |
4.4 |
-8.43 |
-1.13 |
0 |
|
|
121807 |
50781964 |
1 |
ClFN3O3H21C24 |
ABC3D3E21F24 |
-109.95 |
1.53 |
-8.31 |
-1.14 |
0 |
|
|
121808 |
50781965 |
1 |
FN3O5C21H22 |
AB3C5D21E22 |
-221.52 |
1.05 |
-8.72 |
-1.13 |
0 |
|
|
121809 |
50782024 |
1 |
ClN3O4H24C26 |
AB3C4D24E26 |
-95.21 |
3.11 |
-8.77 |
-1.16 |
0 |
|
|
121810 |
50782134 |
1 |
N3O4C23H29 |
A3B4C23D29 |
-135.17 |
2.24 |
-8.19 |
-0.85 |
0 |
|
|
121811 |
50782288 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-116.37 |
2.82 |
-8.37 |
-0.89 |
0 |
|
|
121812 |
50782380 |
1 |
N3O4C24H29 |
A3B4C24D29 |
-115.45 |
4.31 |
-8.34 |
-0.71 |
0 |
|
|
121813 |
50782399 |
1 |
N3O4C25H25 |
A3B4C25D25 |
-92.79 |
4.08 |
-8.17 |
-0.97 |
0 |
|
|
121814 |
50782400 |
1 |
FN3O3H24C25 |
AB3C3D24E25 |
-95.27 |
2.69 |
-8.24 |
-0.9 |
0 |
|
|
121815 |
50782432 |
1 |
BrN3O3C19H20 |
AB3C3D19E20 |
-73.13 |
2.31 |
-8.4 |
-1.11 |
0 |
|
|
121816 |
50782442 |
2 |
N2O3C12H15 |
A2B3C12D15 |
-196.4 |
1.15 |
-8.98 |
-1.16 |
0 |
|
|
121817 |
50782553 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-121.22 |
5.77 |
-8.6 |
-0.55 |
0 |
|
|
121818 |
50782566 |
1 |
N4O5C25H32 |
A4B5C25D32 |
-181.83 |
2.41 |
-9.0 |
-1.04 |
0 |
|
|
121819 |
50782568 |
1 |
ClFN3O3H23C25 |
ABC3D3E23F25 |
-98.86 |
4.09 |
-8.41 |
-0.98 |
0 |
|
|
121820 |
50782633 |
1 |
FN4O4C21H25 |
AB4C4D21E25 |
-166.39 |
6.18 |
-8.41 |
-0.82 |
0 |
|
|
121821 |
50782691 |
1 |
O4N5C25H27 |
A4B5C25D27 |
-86.23 |
3.62 |
-8.24 |
-0.92 |
0 |
|
|
121822 |
50782727 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-139.73 |
1.29 |
-8.25 |
-0.77 |
0 |
|
|
121823 |
50782732 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-96.2 |
1.68 |
-8.1 |
-0.83 |
0 |
|
|
121824 |
50782733 |
1 |
SN2O3C19H22 |
AB2C3D19E22 |
-98.15 |
2.5 |
-8.32 |
-0.86 |
0 |
|
|
121825 |
50782774 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-105.2 |
2.38 |
-8.54 |
-0.78 |
0 |
|
|
121826 |
50782775 |
1 |
N2O3C22H26 |
A2B3C22D26 |
-108.72 |
4.53 |
-8.27 |
-0.86 |
0 |
|
|
121827 |
50782956 |
1 |
FN2O5C22H23 |
AB2C5D22E23 |
-227.66 |
1.08 |
-8.16 |
-0.83 |
0 |
|
|
121828 |
50782985 |
1 |
BrN2O3C19H21 |
AB2C3D19E21 |
-92.75 |
1.51 |
-8.26 |
-1.0 |
0 |
|
|
121829 |
50783040 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-90.42 |
6.87 |
-8.35 |
-1.14 |
0 |
|
|
121830 |
50783090 |
2 |
ON3C11H13 |
AB3C11D13 |
25.9 |
9.96 |
-8.76 |
-0.88 |
0 |
|
|
121831 |
50783091 |
1 |
O2N8C27H30 |
A2B8C27D30 |
74.59 |
11.58 |
-8.46 |
-0.81 |
0 |
|
|
121832 |
50783173 |
1 |
ClON6C21H25 |
ABC6D21E25 |
42.78 |
11.12 |
-8.78 |
-0.91 |
0 |
|
|
121833 |
50783174 |
1 |
ClON6C19H21 |
ABC6D19E21 |
54.77 |
12.29 |
-8.72 |
-0.88 |
0 |
|
|
121834 |
50783222 |
2 |
ON4C13H18 |
AB4C13D18 |
25.26 |
8.45 |
-8.26 |
-0.71 |
0 |
|
|
121835 |
50783228 |
1 |
ON7C27H37 |
AB7C27D37 |
48.1 |
8.01 |
-8.75 |
-0.89 |
0 |
|
|
121836 |
50783351 |
1 |
ClON6C25H29 |
ABC6D25E29 |
57.64 |
8.08 |
-9.21 |
-0.97 |
0 |
|
|
121837 |
50783421 |
1 |
ON6C21H26 |
AB6C21D26 |
52.23 |
10.81 |
-9.04 |
-0.86 |
0 |
|
|
121838 |
50783422 |
1 |
ON7C29H33 |
AB7C29D33 |
92.21 |
11.17 |
-8.53 |
-0.74 |
0 |
|
|
121839 |
50783423 |
1 |
ON7C25H33 |
AB7C25D33 |
53.67 |
10.81 |
-8.61 |
-0.78 |
0 |
|
|
121840 |
50783424 |
1 |
ClO2N6C25H25 |
AB2C6D25E25 |
50.41 |
12.54 |
-8.74 |
-0.76 |
0 |
|
|
121841 |
50783425 |
1 |
ClON6C25H25 |
ABC6D25E25 |
77.9 |
10.83 |
-8.99 |
-0.89 |
0 |
|
|
121842 |
50783448 |
1 |
ON4H18C23 |
AB4C18D23 |
76.15 |
2.53 |
-8.93 |
-0.98 |
0 |
|
|
121843 |
50783584 |
1 |
FO3N4H21C25 |
AB3C4D21E25 |
-50.77 |
3.46 |
-8.35 |
-0.92 |
0 |
|
|
121844 |
50783589 |
4 |
NOC7H8 |
ABC7D8 |
-103.79 |
6.99 |
-8.3 |
-1.17 |
0 |
|
|
121845 |
50783694 |
1 |
FO2N4C21H21 |
AB2C4D21E21 |
-45.68 |
4.78 |
-9.15 |
-0.98 |
0 |
|
|
121846 |
50783970 |
1 |
N5O5C22H29 |
A5B5C22D29 |
-168.72 |
4.83 |
-8.6 |
-1.3 |
0 |
|
|
121847 |
50783971 |
1 |
N5O5C22H29 |
A5B5C22D29 |
-172.61 |
8.45 |
-8.62 |
-1.34 |
0 |
|
|
121848 |
50783978 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-93.98 |
7.52 |
-8.38 |
-1.13 |
0 |
|
|
121849 |
50783988 |
1 |
O4N5C22H29 |
A4B5C22D29 |
-132.96 |
5.15 |
-8.35 |
-1.07 |
0 |
|
|
121850 |
50783997 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-42.97 |
7.32 |
-8.54 |
-1.25 |
0 |
|
|
121851 |
50784000 |
1 |
ClN3O4H18C21 |
AB3C4D18E21 |
-100.17 |
2.54 |
-8.51 |
-1.25 |
0 |
|
|
121852 |
50784044 |
1 |
FO4N5C26H28 |
AB4C5D26E28 |
-150.1 |
4.56 |
-8.45 |
-1.25 |
0 |
|
|
121853 |
50784150 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-63.77 |
8.06 |
-8.43 |
-1.2 |
0 |
|
|
121854 |
50784221 |
2 |
N2O2C13H15 |
A2B2C13D15 |
-102.18 |
6.54 |
-8.52 |
-1.34 |
0 |
|
|
121855 |
50784223 |
1 |
N4O4H28C29 |
A4B4C28D29 |
-69.35 |
3.99 |
-8.25 |
-1.12 |
0 |
|
|
121856 |
50784326 |
1 |
O2N5H25C29 |
A2B5C25D29 |
35.46 |
7.55 |
-8.44 |
-1.12 |
0 |
|
|
121857 |
50784334 |
1 |
ClO2N6H25C27 |
AB2C6D25E27 |
45.17 |
9.24 |
-8.63 |
-1.28 |
0 |
|
|
121858 |
50784355 |
1 |
O3N6C29H30 |
A3B6C29D30 |
15.66 |
4.0 |
-8.64 |
-0.93 |
0 |
|
|
121859 |
50784356 |
1 |
O3N4C23H24 |
A3B4C23D24 |
-39.92 |
7.52 |
-9.13 |
-1.28 |
0 |
|
|
121860 |
50784419 |
1 |
O3N4C29H30 |
A3B4C29D30 |
-51.39 |
3.06 |
-8.47 |
-0.14 |
0 |
|
|
121861 |
50784465 |
1 |
O3N4C20H20 |
A3B4C20D20 |
-35.41 |
7.61 |
-9.11 |
-1.28 |
0 |