List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
334940 |
127253746 |
1 |
ClNO6C23H24 |
ABC6D23E24 |
-188.4 |
4.34 |
-8.91 |
-0.53 |
0 |
|
|
334941 |
127253747 |
2 |
NO2H13C14 |
AB2C13D14 |
-48.49 |
2.76 |
-8.38 |
-1.53 |
0 |
|
|
334942 |
127253748 |
1 |
O6N7C35H37 |
A6B7C35D37 |
-65.93 |
11.98 |
-8.32 |
-1.36 |
0 |
|
|
334943 |
127253749 |
1 |
N2O6H14C19 |
A2B6C14D19 |
-170.18 |
7.21 |
-8.58 |
-1.49 |
0 |
|
|
334944 |
127253750 |
1 |
N2F3O5H17C20 |
A2B3C5D17E20 |
-273.26 |
3.11 |
-8.95 |
-1.11 |
0 |
|
|
334945 |
127253751 |
1 |
N4O5C26H28 |
A4B5C26D28 |
-177.91 |
7.46 |
-8.93 |
-1.02 |
0 |
|
|
334946 |
127253752 |
1 |
SN3O6C27H29 |
AB3C6D27E29 |
-162.97 |
4.78 |
-8.73 |
-0.59 |
0 |
|
|
334947 |
127253753 |
2 |
N2O3C19H23 |
A2B3C19D23 |
-165.78 |
3.41 |
-8.54 |
-0.47 |
0 |
|
|
334948 |
127253754 |
1 |
N3O3C24H25 |
A3B3C24D25 |
-71.77 |
4.58 |
-8.36 |
-0.42 |
0 |
|
|
334949 |
127253755 |
1 |
N3O7C31H35 |
A3B7C31D35 |
-214.65 |
3.17 |
-8.52 |
-0.31 |
0 |
|
|
334950 |
127253756 |
1 |
N3O4H19C26 |
A3B4C19D26 |
-25.53 |
3.28 |
-8.37 |
-1.57 |
0 |
|
|
334951 |
127253757 |
1 |
NO5H15C17 |
AB5C15D17 |
-166.81 |
6.21 |
-8.57 |
-0.82 |
0 |
|
|
334952 |
127253758 |
2 |
O4H15C18 |
A4B15C18 |
-191.88 |
6.62 |
-8.38 |
-1.28 |
0 |
|
|
334953 |
127253759 |
1 |
O9H32C37 |
A9B32C37 |
-229.37 |
3.03 |
-8.5 |
-1.49 |
0 |
|
|
334954 |
127253760 |
1 |
N3O6H23C26 |
A3B6C23D26 |
-172.34 |
8.62 |
-9.2 |
-1.03 |
0 |
|
|
334955 |
127253761 |
1 |
N5O6C24H25 |
A5B6C24D25 |
-134.44 |
11.89 |
-9.57 |
-1.5 |
0 |
|
|
334956 |
127253762 |
1 |
N3O4H21C24 |
A3B4C21D24 |
15.02 |
6.13 |
-7.8 |
-1.53 |
0 |
|
|
334957 |
127253763 |
1 |
SN2O4H18C23 |
AB2C4D18E23 |
-49.58 |
3.32 |
-8.36 |
-1.35 |
0 |
|
|
334958 |
127253764 |
1 |
NO6H21C29 |
AB6C21D29 |
-102.11 |
6.1 |
-8.95 |
-1.44 |
0 |
|
|
334959 |
127253765 |
4 |
NOC6H6 |
ABC6D6 |
-93.01 |
8.54 |
-8.94 |
-0.59 |
0 |
|
|
334960 |
127253766 |
1 |
ClN3O7H22C25 |
AB3C7D22E25 |
-167.76 |
2.94 |
-8.46 |
-1.18 |
0 |
|
|
334961 |
127253767 |
2 |
NO2H12C13 |
AB2C12D13 |
-91.72 |
4.35 |
-8.14 |
-1.23 |
0 |
|
|
334962 |
127253768 |
1 |
N4O5C31H34 |
A4B5C31D34 |
-72.3 |
8.99 |
-9.1 |
-1.38 |
0 |
|
|
334963 |
127253769 |
1 |
N3O7H25C27 |
A3B7C25D27 |
-162.16 |
5.46 |
-8.68 |
-0.82 |
0 |
|
|
334964 |
127253770 |
1 |
N3O8C36H37 |
A3B8C36D37 |
-253.4 |
8.26 |
-9.0 |
-0.57 |
0 |
|
|
334965 |
127253771 |
1 |
NO8H15C27 |
AB8C15D27 |
-207.65 |
6.22 |
-8.73 |
-1.52 |
0 |
|
|
334966 |
127253772 |
1 |
N3O4H21C23 |
A3B4C21D23 |
-92.02 |
7.73 |
-8.24 |
-0.69 |
0 |
|
|
334967 |
127253773 |
3 |
NOC8H13 |
ABC8D13 |
-130.62 |
4.95 |
-8.2 |
0.28 |
0 |
|
|
334968 |
127253774 |
1 |
NO7H25C28 |
AB7C25D28 |
-178.15 |
4.74 |
-8.43 |
-1.47 |
0 |
|
|
334969 |
127253775 |
6 |
NOC6H8 |
ABC6D8 |
-126.38 |
10.47 |
-8.34 |
-0.91 |
0 |
|
|
334970 |
127253776 |
1 |
N6O6C29H36 |
A6B6C29D36 |
-76.49 |
7.74 |
-8.71 |
-1.29 |
0 |
|
|
334971 |
127253777 |
1 |
N3O4C26H29 |
A3B4C26D29 |
-82.38 |
3.5 |
-8.29 |
-1.42 |
0 |
|
|
334972 |
127253778 |
1 |
ClN2O8H31C34 |
AB2C8D31E34 |
-267.19 |
4.11 |
-8.57 |
-0.64 |
0 |
|
|
334973 |
127253779 |
1 |
N4O5H24C25 |
A4B5C24D25 |
-128.11 |
8.18 |
-8.29 |
-0.71 |
0 |
|
|
334974 |
127253780 |
1 |
NO7C27H27 |
AB7C27D27 |
-249.93 |
8.16 |
-9.27 |
-0.79 |
0 |
|
|
334975 |
127253781 |
1 |
ClN2O5H21C22 |
AB2C5D21E22 |
-130.75 |
8.45 |
-9.02 |
-0.66 |
0 |
|
|
334976 |
127253782 |
1 |
N3O3C24H35 |
A3B3C24D35 |
-98.62 |
3.62 |
-8.64 |
0.17 |
0 |
|
|
334977 |
127253783 |
1 |
O3N5C25H25 |
A3B5C25D25 |
-41.02 |
2.65 |
-9.13 |
-0.92 |
0 |
|
|
334978 |
127253784 |
1 |
ClN4O7C22H23 |
AB4C7D22E23 |
-183.7 |
1.67 |
-8.88 |
-0.71 |
0 |
|
|
334979 |
127253785 |
1 |
ClN4O9H31C34 |
AB4C9D31E34 |
-288.26 |
4.98 |
-8.68 |
-0.74 |
0 |
|
|
334980 |
127253786 |
1 |
ClN4O8H29C34 |
AB4C8D29E34 |
-241.58 |
5.7 |
-8.66 |
-0.78 |
0 |
|
|
334981 |
127253787 |
1 |
N6O6C35H40 |
A6B6C35D40 |
-102.51 |
3.34 |
-8.33 |
-0.72 |
0 |
|
|
334982 |
127253788 |
1 |
N5O6H23C24 |
A5B6C23D24 |
-68.33 |
9.84 |
-8.1 |
-1.42 |
0 |
|
|
334983 |
127253789 |
1 |
Cl2N4O6H20C25 |
A2B4C6D20E25 |
-113.19 |
2.91 |
-8.97 |
-1.51 |
0 |
|
|
334984 |
127253790 |
1 |
N3O3C25H33 |
A3B3C25D33 |
-36.41 |
3.43 |
-8.32 |
0.13 |
0 |
|
|
334985 |
127253791 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-146.13 |
3.8 |
-8.45 |
-0.64 |
0 |
|
|
334986 |
127253792 |
1 |
N4O8C35H40 |
A4B8C35D40 |
-243.27 |
6.7 |
-8.47 |
-0.86 |
0 |
|
|
334988 |
127253794 |
1 |
N3O8C32H37 |
A3B8C32D37 |
-291.75 |
5.1 |
-8.86 |
-0.44 |
0 |
|
|
334989 |
127253795 |
1 |
N2O4C23H26 |
A2B4C23D26 |
-119.1 |
4.13 |
-8.35 |
-0.37 |
0 |
|
|
334990 |
127253796 |
1 |
N4O6H20C25 |
A4B6C20D25 |
-85.73 |
6.57 |
-8.32 |
-1.57 |
0 |
|
|
334991 |
127253797 |
1 |
N5O5H23C24 |
A5B5C23D24 |
-63.39 |
4.2 |
-8.39 |
-1.44 |
0 |
|
|
334992 |
127253798 |
1 |
N3O4H21C27 |
A3B4C21D27 |
-21.32 |
2.13 |
-8.69 |
-1.76 |
0 |
|
|
334993 |
127253799 |
1 |
O4N6C31H32 |
A4B6C31D32 |
-6.15 |
9.34 |
-9.14 |
-1.36 |
0 |
|
|
334995 |
127253801 |
1 |
N2O6C21H22 |
A2B6C21D22 |
-177.26 |
5.04 |
-8.83 |
-0.44 |
0 |
|
|
334996 |
127253802 |
1 |
N3O6C22H23 |
A3B6C22D23 |
-183.37 |
3.29 |
-8.57 |
-0.48 |
0 |
|
|
334997 |
127253803 |
1 |
NO5H27C29 |
AB5C27D29 |
-107.9 |
3.51 |
-8.3 |
-1.41 |
0 |
|
|
334998 |
127253804 |
1 |
O9H22C28 |
A9B22C28 |
-227.89 |
2.95 |
-8.43 |
-1.42 |
0 |
|
|
334999 |
127253805 |
1 |
O3N5H23C25 |
A3B5C23D25 |
-37.99 |
10.42 |
-8.18 |
-0.64 |
0 |
|
|
335000 |
127253806 |
1 |
SO4N5C28H31 |
AB4C5D28E31 |
-25.76 |
7.22 |
-9.24 |
-1.46 |
0 |
|
|
335001 |
127253807 |
1 |
N5O6C29H29 |
A5B6C29D29 |
-34.3 |
5.86 |
-9.12 |
-1.18 |
0 |
|
|
335002 |
127253808 |
2 |
N2O2H11C12 |
A2B2C11D12 |
-81.58 |
4.2 |
-9.28 |
-1.02 |
0 |
|
|
335003 |
127253809 |
1 |
N3O4C28H31 |
A3B4C28D31 |
-139.41 |
3.0 |
-9.14 |
-0.9 |
0 |
|
|
335004 |
127253810 |
1 |
N2O6H16C17 |
A2B6C16D17 |
-172.0 |
5.95 |
-9.01 |
-0.6 |
0 |
|
|
335005 |
127253811 |
1 |
O4N5C26H29 |
A4B5C26D29 |
-69.73 |
7.5 |
-8.16 |
-0.33 |
0 |
|
|
335006 |
127253812 |
1 |
N3O4C18H19 |
A3B4C18D19 |
-111.29 |
7.88 |
-8.66 |
-0.66 |
0 |
|
|
335007 |
127253813 |
1 |
ClNO7H20C24 |
ABC7D20E24 |
-239.01 |
6.59 |
-9.34 |
-1.11 |
0 |
|
|
335008 |
127253814 |
1 |
ClN4O6H23C26 |
AB4C6D23E26 |
-138.22 |
10.32 |
-9.07 |
-1.14 |
0 |
|
|
335009 |
127253815 |
1 |
ClN2O6C22H27 |
AB2C6D22E27 |
-228.28 |
9.04 |
-8.86 |
-0.52 |
0 |
|
|
335010 |
127253816 |
1 |
N2F3O5H17C20 |
A2B3C5D17E20 |
-273.5 |
4.66 |
-8.98 |
-1.19 |
0 |
|
|
335011 |
127253817 |
1 |
N2O5H24C29 |
A2B5C24D29 |
-80.13 |
5.74 |
-8.62 |
-1.47 |
0 |
|
|
335012 |
127253818 |
1 |
ClN5O5H22C24 |
AB5C5D22E24 |
-58.42 |
7.39 |
-8.88 |
-0.94 |
0 |
|
|
335013 |
127253819 |
1 |
ClN4O5C20H21 |
AB4C5D20E21 |
-113.34 |
8.96 |
-8.72 |
-0.34 |
0 |
|
|
335014 |
127253820 |
2 |
NO2C8H10 |
AB2C8D10 |
-163.28 |
3.48 |
-8.99 |
0.12 |
0 |
|
|
335015 |
127253821 |
1 |
N3O6C28H31 |
A3B6C28D31 |
-172.07 |
6.01 |
-8.87 |
-0.58 |
0 |
|
|
335016 |
127253822 |
1 |
NO6H23C24 |
AB6C23D24 |
-153.27 |
3.42 |
-8.82 |
-0.86 |
0 |