List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
358885 |
127296756 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-73.78 |
6.08 |
-8.33 |
0.18 |
0 |
|
|
358886 |
127296757 |
1 |
ON6C20H34 |
AB6C20D34 |
-26.97 |
6.57 |
-8.5 |
0.77 |
0 |
|
|
358887 |
127296758 |
1 |
SN3O3C13H25 |
AB3C3D13E25 |
-137.75 |
7.21 |
-9.78 |
0.3 |
0 |
|
|
358888 |
127296759 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-72.21 |
5.38 |
-9.39 |
-0.47 |
0 |
|
|
358889 |
127296780 |
1 |
OSN5C17H29 |
ABC5D17E29 |
-28.85 |
4.12 |
-8.65 |
-0.6 |
0 |
|
|
358890 |
127296781 |
1 |
ON4C21H30 |
AB4C21D30 |
-5.12 |
4.75 |
-8.35 |
0.16 |
0 |
|
|
358891 |
127296782 |
1 |
N3O3C16H31 |
A3B3C16D31 |
-150.86 |
5.49 |
-8.94 |
1.13 |
0 |
|
|
358892 |
127296783 |
1 |
O2N5C18H35 |
A2B5C18D35 |
-101.0 |
3.69 |
-8.59 |
1.1 |
0 |
|
|
358893 |
127296784 |
1 |
O2N3C18H33 |
A2B3C18D33 |
-129.99 |
6.73 |
-8.78 |
1.23 |
0 |
|
|
358894 |
127296785 |
1 |
O2N5C20H39 |
A2B5C20D39 |
-109.09 |
3.93 |
-8.52 |
1.35 |
0 |
|
|
358895 |
127296786 |
1 |
N2O3C19H28 |
A2B3C19D28 |
-133.73 |
1.05 |
-8.89 |
0.18 |
0 |
|
|
358896 |
127296787 |
1 |
ON7C19H33 |
AB7C19D33 |
-15.43 |
5.44 |
-8.74 |
0.41 |
0 |
|
|
358897 |
127296788 |
1 |
O2N5C22H33 |
A2B5C22D33 |
-54.25 |
6.13 |
-8.74 |
-0.08 |
0 |
|
|
358898 |
127296789 |
1 |
SO2N3C15H23 |
AB2C3D15E23 |
-47.34 |
3.14 |
-9.32 |
-0.49 |
0 |
|
|
358899 |
127296790 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-115.54 |
4.01 |
-9.17 |
0.98 |
0 |
|
|
358900 |
127296791 |
1 |
O3N4C18H32 |
A3B4C18D32 |
-130.37 |
4.58 |
-8.83 |
0.78 |
0 |
|
|
358901 |
127296792 |
1 |
N3O4C16H27 |
A3B4C16D27 |
-162.44 |
3.93 |
-9.13 |
0.76 |
0 |
|
|
358902 |
127296793 |
1 |
ON4C22H30 |
AB4C22D30 |
-13.93 |
6.28 |
-9.2 |
0.54 |
0 |
|
|
358903 |
127296794 |
1 |
ON5C22H29 |
AB5C22D29 |
13.8 |
1.25 |
-8.83 |
-0.41 |
0 |
|
|
358904 |
127296795 |
2 |
ON2C11H16 |
AB2C11D16 |
-84.08 |
8.73 |
-9.06 |
0.49 |
0 |
|
|
358905 |
127296796 |
1 |
ON4C22H30 |
AB4C22D30 |
-21.26 |
3.41 |
-9.04 |
0.36 |
0 |
|
|
358906 |
127296797 |
1 |
SO3N6C17H28 |
AB3C6D17E28 |
-90.75 |
3.19 |
-8.8 |
-0.44 |
0 |
|
|
358907 |
127296798 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-71.18 |
6.77 |
-8.86 |
-0.11 |
0 |
|
|
358908 |
127296799 |
1 |
O2N4C19H30 |
A2B4C19D30 |
-81.21 |
3.73 |
-8.86 |
-0.46 |
0 |
|
|
358909 |
127296800 |
1 |
ON5C19H31 |
AB5C19D31 |
-29.26 |
4.95 |
-8.6 |
-0.34 |
0 |
|
|
358910 |
127296801 |
2 |
ON2C11H15 |
AB2C11D15 |
-57.12 |
5.05 |
-9.04 |
0.05 |
0 |
|
|
358911 |
127296802 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-16.97 |
1.29 |
-8.79 |
-0.31 |
0 |
|
|
358912 |
127296803 |
2 |
ON2C11H15 |
AB2C11D15 |
-34.54 |
5.71 |
-8.55 |
0.54 |
0 |
|
|
358913 |
127296804 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-23.37 |
3.67 |
-8.85 |
-0.42 |
0 |
|
|
358914 |
127296805 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-158.77 |
8.57 |
-8.62 |
-0.57 |
0 |
|
|
358915 |
127296806 |
1 |
N3O4C21H29 |
A3B4C21D29 |
-165.61 |
2.12 |
-8.49 |
-0.18 |
0 |
|
|
358916 |
127296807 |
1 |
O2N4C19H34 |
A2B4C19D34 |
-126.58 |
6.03 |
-8.85 |
0.91 |
0 |
|
|
358917 |
127296808 |
1 |
ON2C11H20 |
AB2C11D20 |
-60.29 |
3.51 |
-9.48 |
1.14 |
0 |
|
|
358918 |
127296809 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-130.96 |
1.3 |
-9.14 |
0.85 |
0 |
|
|
358919 |
127296810 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-127.84 |
3.43 |
-9.18 |
1.04 |
0 |
|
|
358920 |
127296811 |
1 |
ON3C14H23 |
AB3C14D23 |
-54.87 |
4.31 |
-9.59 |
1.07 |
0 |
|
|
358921 |
127296812 |
1 |
ON5C23H37 |
AB5C23D37 |
-43.31 |
5.32 |
-8.36 |
0.24 |
0 |
|
|
358922 |
127296813 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-111.67 |
7.7 |
-9.65 |
0.74 |
0 |
|
|
358923 |
127296814 |
1 |
O2N4C15H28 |
A2B4C15D28 |
-115.24 |
1.44 |
-9.02 |
0.83 |
0 |
|
|
358924 |
127296815 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-131.83 |
3.61 |
-9.52 |
1.17 |
0 |
|
|
358925 |
127296816 |
1 |
ON4C16H26 |
AB4C16D26 |
-45.98 |
5.12 |
-9.33 |
0.68 |
0 |
|
|
358926 |
127296817 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-96.9 |
3.64 |
-9.27 |
0.21 |
0 |
|
|
358927 |
127296818 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-84.11 |
1.46 |
-9.47 |
0.12 |
0 |
|
|
358928 |
127296819 |
2 |
ON2C8H14 |
AB2C8D14 |
-118.53 |
2.4 |
-9.23 |
1.0 |
0 |
|
|
358929 |
127296820 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-121.09 |
3.05 |
-9.5 |
0.85 |
0 |
|
|
358930 |
127296821 |
1 |
ON4C16H26 |
AB4C16D26 |
-51.74 |
1.97 |
-9.19 |
0.64 |
0 |
|
|
358931 |
127296822 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-118.76 |
4.81 |
-9.32 |
1.1 |
0 |
|
|
358932 |
127296823 |
1 |
ON3C14H27 |
AB3C14D27 |
-75.16 |
4.65 |
-8.6 |
1.26 |
0 |
|
|
358933 |
127296824 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-129.48 |
2.92 |
-9.3 |
0.95 |
0 |
|
|
358934 |
127296825 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-71.39 |
3.28 |
-9.25 |
-0.05 |
0 |
|
|
358935 |
127296826 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-131.63 |
5.97 |
-9.38 |
1.18 |
0 |
|
|
358936 |
127296827 |
2 |
NOC7H13 |
ABC7D13 |
-125.79 |
2.82 |
-9.27 |
1.38 |
0 |
|
|
358937 |
127296828 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-127.6 |
4.03 |
-9.16 |
1.06 |
0 |
|
|
358938 |
127296829 |
1 |
ON4C16H24 |
AB4C16D24 |
-43.93 |
4.47 |
-9.67 |
-0.35 |
0 |
|
|
358939 |
127296830 |
2 |
ON2C10H18 |
AB2C10D18 |
-133.1 |
6.15 |
-8.83 |
0.99 |
0 |
|
|
358940 |
127296831 |
1 |
SO3N4C14H22 |
AB3C4D14E22 |
-84.43 |
8.76 |
-9.5 |
-0.36 |
0 |
|
|
358941 |
127296832 |
1 |
SO4N5C17H27 |
AB4C5D17E27 |
-147.27 |
13.31 |
-9.06 |
-0.6 |
0 |
|
|
358942 |
127296833 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-93.45 |
2.4 |
-9.13 |
-0.98 |
0 |
|
|
358943 |
127296834 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-137.34 |
3.1 |
-9.69 |
-0.17 |
0 |
|
|
358944 |
127296835 |
1 |
O2N4C11H22 |
A2B4C11D22 |
-105.11 |
5.38 |
-9.2 |
0.96 |
0 |
|
|
358945 |
127296836 |
2 |
NOC7H10 |
ABC7D10 |
-98.45 |
2.17 |
-9.8 |
0.18 |
0 |
|
|
358946 |
127296837 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-91.62 |
2.57 |
-9.75 |
0.21 |
0 |
|
|
358947 |
127296838 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-86.79 |
5.38 |
-9.5 |
-0.06 |
0 |
|
|
358948 |
127296839 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-66.78 |
3.56 |
-8.91 |
-1.18 |
0 |
|
|
358949 |
127296840 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-94.62 |
3.68 |
-9.46 |
0.01 |
0 |
|
|
358951 |
127296842 |
1 |
SN2O2C12H16 |
AB2C2D12E16 |
-80.77 |
1.82 |
-9.04 |
-0.14 |
0 |
|
|
358952 |
127296843 |
1 |
OSN6C10H16 |
ABC6D10E16 |
-0.48 |
3.15 |
-9.32 |
-0.47 |
0 |
|
|
358954 |
127296845 |
1 |
OS2N3C17H21 |
AB2C3D17E21 |
-4.67 |
5.15 |
-8.89 |
-1.12 |
0 |
|
|
358955 |
127296846 |
1 |
OS2N3C16H19 |
AB2C3D16E19 |
8.82 |
3.12 |
-8.57 |
-0.92 |
0 |
|
|
358956 |
127296847 |
1 |
SN3O4C16H23 |
AB3C4D16E23 |
-152.49 |
3.94 |
-9.65 |
-0.9 |
0 |
|
|
358957 |
127296848 |
1 |
S2N3O3C17H25 |
A2B3C3D17E25 |
-107.71 |
5.01 |
-9.31 |
-1.21 |
0 |
|
|
358958 |
127296849 |
1 |
S2N3O4C16H23 |
A2B3C4D16E23 |
-129.92 |
5.91 |
-9.45 |
-1.32 |
0 |
|
|
358959 |
127296850 |
1 |
S2N3O3C16H23 |
A2B3C3D16E23 |
-96.3 |
3.83 |
-9.39 |
-1.32 |
0 |
|
|
358960 |
127296851 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-88.63 |
2.43 |
-9.69 |
0.14 |
0 |
|
|
358961 |
127296852 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-136.49 |
6.58 |
-9.72 |
-0.27 |
0 |
|
|
358962 |
127296853 |
1 |
OSN3C17H21 |
ABC3D17E21 |
-2.56 |
6.08 |
-9.04 |
-1.03 |
0 |
|
|
358964 |
127296855 |
1 |
SN3O3C14H17 |
AB3C3D14E17 |
-79.56 |
3.94 |
-9.53 |
-1.22 |
0 |
|
|
358965 |
127296856 |
1 |
O2S2N4C13H20 |
A2B2C4D13E20 |
-27.7 |
5.0 |
-8.81 |
-1.11 |
0 |
|
|
358966 |
127296857 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-123.48 |
1.74 |
-9.93 |
0.0 |
0 |
|
|
358967 |
127296858 |
1 |
N3O4C15H19 |
A3B4C15D19 |
-124.27 |
3.67 |
-9.54 |
-0.19 |
0 |
|
|
358968 |
127296859 |
1 |
SN2O2C13H18 |
AB2C2D13E18 |
-87.29 |
0.93 |
-8.79 |
-0.02 |
0 |
|
|
358969 |
127296860 |
1 |
O2S2N5C16H25 |
A2B2C5D16E25 |
-43.33 |
2.16 |
-8.33 |
-0.64 |
0 |
|
|
358970 |
127296861 |
1 |
OS2N5C14H23 |
AB2C5D14E23 |
19.29 |
5.92 |
-8.62 |
-1.01 |
0 |
|
|
358971 |
127296862 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-40.34 |
2.81 |
-8.98 |
-0.53 |
0 |
|
|
358972 |
127296863 |
1 |
O2N3C23H25 |
A2B3C23D25 |
10.88 |
4.54 |
-8.91 |
-0.47 |
0 |
|
|
358973 |
127296864 |
1 |
ON5C23H25 |
AB5C23D25 |
49.87 |
2.95 |
-9.6 |
-1.43 |
0 |
|
|
358974 |
127296865 |
1 |
ON4C22H22 |
AB4C22D22 |
64.17 |
2.8 |
-9.13 |
-0.74 |
0 |
|
|
358975 |
127296866 |
1 |
O2N4C23H24 |
A2B4C23D24 |
18.45 |
5.09 |
-9.15 |
-0.89 |
0 |
|
|
358976 |
127296867 |
1 |
ON5C21H23 |
AB5C21D23 |
55.65 |
3.13 |
-9.65 |
-1.4 |
0 |
|
|
358977 |
127296868 |
1 |
O2N3C24H27 |
A2B3C24D27 |
10.38 |
1.88 |
-8.88 |
-0.45 |
0 |
|
|
358978 |
127296869 |
1 |
SO3N5C17H23 |
AB3C5D17E23 |
-60.39 |
8.6 |
-9.22 |
-1.24 |
0 |
|
|
358979 |
127296870 |
1 |
O2N4C11H12 |
A2B4C11D12 |
-8.01 |
3.45 |
-9.19 |
-1.01 |
0 |
|
|
358980 |
127296871 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-96.25 |
7.27 |
-8.91 |
-0.03 |
0 |
|
|
358981 |
127296872 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-60.84 |
4.84 |
-8.58 |
-1.27 |
0 |
|
|
358982 |
127296873 |
2 |
NSO2C9H13 |
ABC2D9E13 |
-158.08 |
7.9 |
-8.68 |
-0.43 |
0 |
|
|
358983 |
127296874 |
1 |
SO3N5C15H17 |
AB3C5D15E17 |
-14.58 |
5.77 |
-9.33 |
-1.34 |
0 |
|
|
358984 |
127296875 |
1 |
SO3N5C16H21 |
AB3C5D16E21 |
-54.56 |
4.48 |
-9.3 |
-1.29 |
0 |
|
|
358985 |
127296876 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-106.1 |
4.5 |
-8.65 |
-0.22 |
0 |
|
|
358986 |
127296877 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-171.63 |
6.12 |
-8.71 |
-0.24 |
0 |
|
|
358987 |
127296878 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-32.03 |
7.6 |
-8.65 |
0.24 |
0 |