List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
65851 |
46386941 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-21.83 |
1.76 |
-9.06 |
-1.08 |
0 |
|
|
65852 |
46386942 |
1 |
N3O5H21C26 |
A3B5C21D26 |
-57.29 |
3.04 |
-8.35 |
-1.11 |
0 |
|
|
65853 |
46386943 |
1 |
N3O5H19C25 |
A3B5C19D25 |
-48.8 |
1.95 |
-8.51 |
-1.18 |
0 |
|
|
65854 |
46386944 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-24.37 |
8.85 |
-8.72 |
-1.4 |
0 |
|
|
65855 |
46386945 |
1 |
N3O3H19C24 |
A3B3C19D24 |
15.57 |
5.73 |
-8.89 |
-1.27 |
0 |
|
|
65856 |
46386946 |
2 |
N2O2H13C14 |
A2B2C13D14 |
-23.65 |
5.84 |
-8.11 |
-1.22 |
0 |
|
|
65857 |
46386947 |
1 |
FN3O3H18C24 |
AB3C3D18E24 |
-32.03 |
5.43 |
-8.98 |
-1.25 |
0 |
|
|
65858 |
46386948 |
1 |
N3O4H21C24 |
A3B4C21D24 |
-29.4 |
2.43 |
-9.07 |
-1.1 |
0 |
|
|
65859 |
46386949 |
1 |
N3O5H23C26 |
A3B5C23D26 |
-60.12 |
5.24 |
-8.18 |
-1.21 |
0 |
|
|
65860 |
46386950 |
1 |
N3O5H23C26 |
A3B5C23D26 |
-71.6 |
4.13 |
-8.87 |
-1.24 |
0 |
|
|
65861 |
46386951 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-23.2 |
8.6 |
-8.36 |
-1.16 |
0 |
|
|
65862 |
46386952 |
1 |
N3O5H23C26 |
A3B5C23D26 |
-64.56 |
4.92 |
-8.22 |
-1.03 |
0 |
|
|
65863 |
46386953 |
1 |
N3O5H25C27 |
A3B5C25D27 |
-64.72 |
4.52 |
-8.63 |
-1.24 |
0 |
|
|
65864 |
46386954 |
1 |
N3O3H21C25 |
A3B3C21D25 |
13.37 |
3.88 |
-9.11 |
-1.08 |
0 |
|
|
65865 |
46386955 |
1 |
N3O5H21C26 |
A3B5C21D26 |
-51.33 |
3.97 |
-8.8 |
-1.06 |
0 |
|
|
65866 |
46386956 |
1 |
N3O5H25C27 |
A3B5C25D27 |
-70.23 |
4.86 |
-8.77 |
-0.99 |
0 |
|
|
65867 |
46386957 |
1 |
N3O4H23C26 |
A3B4C23D26 |
-27.43 |
4.16 |
-8.97 |
-1.18 |
0 |
|
|
65868 |
46386958 |
1 |
N3O4H23C26 |
A3B4C23D26 |
-27.63 |
8.75 |
-8.96 |
-1.1 |
0 |
|
|
65869 |
46386959 |
1 |
FO2N3H20C21 |
AB2C3D20E21 |
-33.92 |
0.61 |
-9.44 |
-1.11 |
0 |
|
|
65870 |
46386960 |
1 |
FO2N3H20C21 |
AB2C3D20E21 |
-34.29 |
3.39 |
-9.3 |
-1.29 |
0 |
|
|
65871 |
46386961 |
1 |
FO2N3H16C20 |
AB2C3D16E20 |
1.97 |
1.86 |
-9.35 |
-1.37 |
0 |
|
|
65872 |
46386962 |
1 |
FO2N3H18C20 |
AB2C3D18E20 |
-32.89 |
7.18 |
-9.4 |
-1.14 |
0 |
|
|
65873 |
46386963 |
1 |
FN3O3C22H22 |
AB3C3D22E22 |
-71.55 |
2.39 |
-9.45 |
-1.16 |
0 |
|
|
65874 |
46386964 |
1 |
FO2N3H18C20 |
AB2C3D18E20 |
-28.95 |
3.89 |
-9.39 |
-1.21 |
0 |
|
|
65875 |
46386965 |
1 |
FO2N3H20C21 |
AB2C3D20E21 |
-36.49 |
5.34 |
-9.38 |
-1.15 |
0 |
|
|
65876 |
46386966 |
1 |
FN3O3H20C22 |
AB3C3D20E22 |
-67.22 |
5.53 |
-9.39 |
-1.18 |
0 |
|
|
65877 |
46386967 |
1 |
FO2N3H20C22 |
AB2C3D20E22 |
-31.92 |
4.34 |
-9.38 |
-1.21 |
0 |
|
|
65878 |
46386968 |
1 |
FO2N3H24C25 |
AB2C3D24E25 |
-26.46 |
7.12 |
-9.4 |
-1.13 |
0 |
|
|
65879 |
46386969 |
1 |
FO2N3H20C21 |
AB2C3D20E21 |
-41.28 |
0.44 |
-9.41 |
-1.08 |
0 |
|
|
65880 |
46386970 |
1 |
FN3O4H18C25 |
AB3C4D18E25 |
-62.98 |
4.81 |
-8.4 |
-1.24 |
0 |
|
|
65881 |
46386971 |
1 |
FN3O4H16C24 |
AB3C4D16E24 |
-53.55 |
2.63 |
-8.5 |
-1.23 |
0 |
|
|
65882 |
46386972 |
1 |
FN3O3H18C24 |
AB3C3D18E24 |
-31.5 |
7.64 |
-8.74 |
-1.3 |
0 |
|
|
65883 |
46386973 |
1 |
FO2N3H16C23 |
AB2C3D16E23 |
10.61 |
6.44 |
-8.92 |
-1.25 |
0 |
|
|
65884 |
46386976 |
1 |
FN3O3H18C23 |
AB3C3D18E23 |
-34.13 |
6.44 |
-9.18 |
-1.12 |
0 |
|
|
65885 |
46386979 |
1 |
FN3O3H18C24 |
AB3C3D18E24 |
-28.95 |
5.16 |
-8.38 |
-1.21 |
0 |
|
|
65886 |
46386980 |
1 |
FN3O4H20C25 |
AB3C4D20E25 |
-69.9 |
4.27 |
-8.26 |
-1.12 |
0 |
|
|
65887 |
46386981 |
1 |
FN3O4H18C25 |
AB3C4D18E25 |
-56.29 |
6.68 |
-8.92 |
-1.15 |
0 |
|
|
65888 |
46386982 |
1 |
O2N3H17C20 |
A2B3C17D20 |
47.73 |
3.07 |
-9.38 |
-1.05 |
0 |
|
|
65889 |
46386983 |
3 |
NOC7H7 |
ABC7D7 |
-18.47 |
1.8 |
-9.35 |
-0.94 |
0 |
|
|
65890 |
46386984 |
1 |
O2N3C21H21 |
A2B3C21D21 |
9.43 |
2.15 |
-9.29 |
-1.04 |
0 |
|
|
65891 |
46386986 |
1 |
O2N3C22H23 |
A2B3C22D23 |
6.95 |
2.52 |
-9.36 |
-0.99 |
0 |
|
|
65892 |
46386990 |
1 |
O2N3C21H21 |
A2B3C21D21 |
6.44 |
5.93 |
-9.3 |
-0.98 |
0 |
|
|
65893 |
46386993 |
1 |
N3O3H19C24 |
A3B3C19D24 |
18.56 |
7.03 |
-8.37 |
-1.14 |
0 |
|
|
65894 |
46386994 |
1 |
N3O4H23C26 |
A3B4C23D26 |
-24.63 |
5.32 |
-8.3 |
-1.01 |
0 |
|
|
65895 |
46386995 |
1 |
O2N3H19C24 |
A2B3C19D24 |
54.63 |
3.32 |
-9.33 |
-1.04 |
0 |
|
|
65896 |
46386997 |
1 |
N3O3H21C25 |
A3B3C21D25 |
13.41 |
3.47 |
-8.92 |
-1.07 |
0 |
|
|
65897 |
46386999 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-27.09 |
1.35 |
-8.81 |
-0.92 |
0 |
|
|
65898 |
46387001 |
1 |
N3O3H19C21 |
A3B3C19D21 |
8.43 |
6.24 |
-8.93 |
-1.08 |
0 |
|
|
65899 |
46387002 |
3 |
NOC7H7 |
ABC7D7 |
-26.51 |
4.24 |
-8.95 |
-0.9 |
0 |
|
|
65900 |
46387005 |
1 |
N3O4C22H23 |
A3B4C22D23 |
-58.38 |
3.33 |
-8.9 |
-0.85 |
0 |
|
|
65901 |
46387009 |
1 |
N3O3C24H25 |
A3B3C24D25 |
-25.85 |
4.08 |
-8.9 |
-0.8 |
0 |
|
|
65902 |
46387010 |
1 |
N3O3C23H23 |
A3B3C23D23 |
-25.73 |
4.34 |
-8.91 |
-0.9 |
0 |
|
|
65903 |
46387012 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-19.55 |
1.61 |
-8.81 |
-0.85 |
0 |
|
|
65904 |
46387013 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-25.63 |
3.18 |
-8.88 |
-0.84 |
0 |
|
|
65905 |
46387014 |
1 |
N3O5H21C26 |
A3B5C21D26 |
-55.21 |
4.37 |
-8.39 |
-1.04 |
0 |
|
|
65906 |
46387015 |
1 |
N3O5H19C25 |
A3B5C19D25 |
-45.64 |
4.94 |
-8.5 |
-1.0 |
0 |
|
|
65907 |
46387016 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-25.17 |
3.41 |
-8.74 |
-1.08 |
0 |
|
|
65908 |
46387018 |
1 |
N3O3H19C24 |
A3B3C19D24 |
17.06 |
2.94 |
-8.89 |
-0.98 |
0 |
|
|
65909 |
46387019 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-21.21 |
5.05 |
-8.43 |
-0.97 |
0 |
|
|
65910 |
46387020 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-32.45 |
4.6 |
-8.95 |
-0.88 |
0 |
|
|
65911 |
46387021 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-36.65 |
2.82 |
-8.78 |
-0.92 |
0 |
|
|
65912 |
46387022 |
1 |
FN3O3H18C24 |
AB3C3D18E24 |
-28.79 |
6.0 |
-8.86 |
-1.16 |
0 |
|
|
65913 |
46387023 |
1 |
N3O4H21C24 |
A3B4C21D24 |
-26.29 |
2.96 |
-8.83 |
-0.89 |
0 |
|
|
65914 |
46387024 |
1 |
N3O5H23C26 |
A3B5C23D26 |
-57.02 |
5.75 |
-8.2 |
-0.93 |
0 |
|
|
65915 |
46387025 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-22.06 |
4.08 |
-8.38 |
-0.93 |
0 |
|
|
65916 |
46387026 |
1 |
N3O5H25C27 |
A3B5C25D27 |
-64.78 |
2.06 |
-8.32 |
-0.96 |
0 |
|
|
65917 |
46387027 |
1 |
N3O3H21C25 |
A3B3C21D25 |
15.33 |
4.26 |
-8.85 |
-0.91 |
0 |
|
|
65918 |
46387028 |
1 |
N3O5H21C26 |
A3B5C21D26 |
-50.06 |
3.4 |
-8.84 |
-0.92 |
0 |
|
|
65919 |
46387037 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-25.38 |
2.86 |
-9.01 |
-0.79 |
0 |
|
|
65920 |
46387051 |
1 |
N3O3H19C24 |
A3B3C19D24 |
23.54 |
1.92 |
-8.85 |
-1.05 |
0 |
|
|
65921 |
46387055 |
1 |
FN3O3H18C24 |
AB3C3D18E24 |
-25.92 |
7.36 |
-8.87 |
-0.94 |
0 |
|
|
65922 |
46387058 |
1 |
F2N3O3H17C24 |
A2B3C3D17E24 |
-75.35 |
5.52 |
-8.98 |
-1.11 |
0 |
|
|
65923 |
46387061 |
1 |
N3O4H21C25 |
A3B4C21D25 |
-17.4 |
2.96 |
-8.35 |
-0.88 |
0 |
|
|
65924 |
46391339 |
1 |
ClSO3N6C22H23 |
ABC3D6E22F23 |
-47.31 |
7.87 |
-9.17 |
-1.54 |
0 |
|
|
65925 |
46391347 |
1 |
SO3N6C24H28 |
AB3C6D24E28 |
-52.02 |
7.24 |
-8.7 |
-1.37 |
0 |
|
|
65926 |
46391352 |
1 |
SO3N6C24H28 |
AB3C6D24E28 |
-54.97 |
5.33 |
-8.48 |
-1.13 |
0 |
|
|
65927 |
46391358 |
1 |
SO3N6C24H28 |
AB3C6D24E28 |
-53.37 |
4.32 |
-8.97 |
-1.23 |
0 |
|
|
65928 |
46391359 |
1 |
FSO3N6C23H25 |
ABC3D6E23F25 |
-93.43 |
7.21 |
-9.12 |
-1.42 |
0 |
|
|
65929 |
46391360 |
1 |
FSO3N6C22H23 |
ABC3D6E22F23 |
-86.81 |
4.74 |
-9.03 |
-1.43 |
0 |
|
|
65930 |
46391361 |
1 |
SO3N6C25H30 |
AB3C6D25E30 |
-61.42 |
6.3 |
-8.82 |
-1.37 |
0 |
|
|
65931 |
46391363 |
1 |
SO3N6C23H26 |
AB3C6D23E26 |
-42.61 |
2.89 |
-9.14 |
-1.42 |
0 |
|
|
65932 |
46391366 |
1 |
SO4N6C24H28 |
AB4C6D24E28 |
-82.65 |
5.79 |
-9.04 |
-1.31 |
0 |
|
|
65933 |
46394457 |
1 |
N2O3H20C23 |
A2B3C20D23 |
-43.35 |
5.03 |
-8.77 |
-0.75 |
0 |
|
|
65934 |
46484600 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
-45.68 |
5.85 |
-8.73 |
-0.73 |
0 |
|
|
65935 |
46484602 |
1 |
ClSN2O2H15C18 |
ABC2D2E15F18 |
-26.96 |
3.68 |
-8.79 |
-1.14 |
0 |
|
|
65936 |
46484605 |
2 |
SN2O2C11H13 |
AB2C2D11E13 |
-125.45 |
7.75 |
-9.03 |
-0.96 |
0 |
|
|
65937 |
46484611 |
1 |
SN4O4C21H22 |
AB4C4D21E22 |
-57.21 |
3.92 |
-8.85 |
-1.4 |
0 |
|
|
65938 |
46484614 |
1 |
NS3O4C13H17 |
AB3C4D13E17 |
-136.92 |
4.99 |
-9.3 |
-1.16 |
0 |
|
|
65939 |
46484615 |
1 |
N2S2O3C16H22 |
A2B2C3D16E22 |
-95.56 |
2.33 |
-8.09 |
-0.76 |
0 |
|
|
65940 |
46484616 |
1 |
FSN3O4H16C19 |
ABC3D4E16F19 |
-57.01 |
10.33 |
-9.07 |
-1.38 |
0 |
|
|
65941 |
46484647 |
1 |
F3N4O4H17C20 |
A3B4C4D17E20 |
-277.84 |
6.18 |
-9.42 |
-0.92 |
0 |
|
|
65942 |
46484657 |
1 |
FSN2O5H17C19 |
ABC2D5E17F19 |
-84.02 |
7.44 |
-8.61 |
-1.44 |
0 |
|
|
65943 |
46484658 |
1 |
FN3O5H14C17 |
AB3C5D14E17 |
-50.0 |
7.56 |
-9.12 |
-1.64 |
0 |
|
|
65944 |
46484660 |
1 |
N3O3F5H14C19 |
A3B3C5D14E19 |
-331.21 |
3.45 |
-9.64 |
-1.02 |
0 |
|
|
65945 |
46484664 |
1 |
FN4O4H15C18 |
AB4C4D15E18 |
-31.59 |
6.88 |
-9.35 |
-1.61 |
0 |
|
|
65946 |
46484667 |
1 |
F3N3O4H18C22 |
A3B3C4D18E22 |
-271.9 |
6.42 |
-10.29 |
-1.48 |
0 |
|
|
65947 |
46484671 |
1 |
SF3N3O5H18C20 |
AB3C3D5E18F20 |
-329.01 |
4.36 |
-9.04 |
-1.06 |
0 |
|
|
65948 |
46484674 |
1 |
F3N3O4C24H26 |
A3B3C4D24E26 |
-298.0 |
1.57 |
-8.85 |
-0.97 |
0 |
|
|
65949 |
46484679 |
1 |
FSN3O4H16C18 |
ABC3D4E16F18 |
-59.67 |
7.65 |
-9.41 |
-1.63 |
0 |
|
|
65950 |
46484680 |
1 |
FSN3O5H14C16 |
ABC3D5E14F16 |
-127.69 |
6.45 |
-8.78 |
-1.7 |
0 |