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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
151889 |
56310713 |
1 |
FN2O3C22H27 |
AB2C3D22E27 |
-130.27 |
5.91 |
-8.19 |
-0.08 |
0 |
|
|
151890 |
56310714 |
1 |
FO3N5C24H34 |
AB3C5D24E34 |
-173.69 |
7.19 |
-8.4 |
-0.3 |
0 |
|
|
151891 |
56310715 |
1 |
ClFN2O3C19H20 |
ABC2D3E19F20 |
-133.9 |
3.17 |
-8.46 |
-0.28 |
0 |
|
|
151892 |
56310716 |
1 |
FO2N3C21H24 |
AB2C3D21E24 |
-99.54 |
2.85 |
-8.67 |
-0.18 |
0 |
|
|
151893 |
56310717 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-82.41 |
2.2 |
-9.13 |
-0.2 |
0 |
|
|
151894 |
56310718 |
1 |
SN3O3C22H29 |
AB3C3D22E29 |
-68.66 |
6.17 |
-9.21 |
-0.55 |
0 |
|
|
151895 |
56310719 |
1 |
ON2C24H32 |
AB2C24D32 |
-9.17 |
4.02 |
-8.73 |
0.1 |
0 |
|
|
151896 |
56310720 |
1 |
SO3N4C24H30 |
AB3C4D24E30 |
-45.91 |
8.62 |
-9.26 |
-0.9 |
0 |
|
|
151897 |
56310721 |
1 |
SN2O2C20H26 |
AB2C2D20E26 |
-50.69 |
2.7 |
-8.35 |
-0.17 |
0 |
|
|
151898 |
56310722 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-24.62 |
3.65 |
-8.54 |
-0.14 |
0 |
|
|
151899 |
56310723 |
1 |
ClO3N4C21H25 |
AB3C4D21E25 |
-83.92 |
6.06 |
-8.84 |
-0.62 |
0 |
|
|
151900 |
56310724 |
1 |
O3N4C21H30 |
A3B4C21D30 |
-68.96 |
3.54 |
-8.66 |
-0.54 |
0 |
|
|
151901 |
56310725 |
1 |
N4O5C23H28 |
A4B5C23D28 |
-92.43 |
5.12 |
-8.6 |
-1.64 |
0 |
|
|
151902 |
56310726 |
1 |
N3O3C25H33 |
A3B3C25D33 |
-107.06 |
4.07 |
-8.48 |
-0.22 |
0 |
|
|
151903 |
56310727 |
1 |
FN3O3C24H30 |
AB3C3D24E30 |
-141.27 |
2.65 |
-8.64 |
-0.12 |
0 |
|
|
151904 |
56310728 |
1 |
N3O5C24H29 |
A3B5C24D29 |
-159.96 |
4.3 |
-8.54 |
-0.26 |
0 |
|
|
151905 |
56310729 |
1 |
N3O4C23H29 |
A3B4C23D29 |
-131.22 |
5.63 |
-8.59 |
-0.1 |
0 |
|
|
151906 |
56310731 |
1 |
N3O4C24H31 |
A3B4C24D31 |
-139.77 |
3.21 |
-8.34 |
-0.01 |
0 |
|
|
151907 |
56310732 |
1 |
ClN3O3C22H26 |
AB3C3D22E26 |
-99.56 |
4.11 |
-8.79 |
-0.32 |
0 |
|
|
151908 |
56310733 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-74.13 |
3.79 |
-8.78 |
-0.92 |
0 |
|
|
151909 |
56310734 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-139.09 |
1.55 |
-8.75 |
-0.34 |
0 |
|
|
151910 |
56310735 |
2 |
ClON2C11H11 |
ABC2D11E11 |
-7.38 |
3.72 |
-9.13 |
-1.55 |
0 |
|
|
151911 |
56310736 |
1 |
FSN2O3C22H27 |
ABC2D3E22F27 |
-138.32 |
7.85 |
-8.91 |
-0.82 |
0 |
|
|
151912 |
56310737 |
1 |
N2O2C23H30 |
A2B2C23D30 |
-57.92 |
3.31 |
-8.55 |
0.2 |
0 |
|
|
151913 |
56310738 |
1 |
BrO2N4C22H23 |
AB2C4D22E23 |
12.31 |
2.46 |
-9.13 |
-1.24 |
0 |
|
|
151914 |
56310739 |
1 |
N3O4C24H31 |
A3B4C24D31 |
-144.77 |
3.81 |
-8.5 |
-0.09 |
0 |
|
|
151915 |
56310740 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-10.79 |
6.01 |
-8.75 |
-0.97 |
0 |
|
|
151916 |
56310742 |
2 |
ON2C13H17 |
AB2C13D17 |
-35.69 |
6.04 |
-8.78 |
0.2 |
0 |
|
|
151917 |
56310743 |
1 |
SO2N4C26H32 |
AB2C4D26E32 |
-46.73 |
2.2 |
-8.76 |
-0.69 |
0 |
|
|
151918 |
56310744 |
1 |
O2N5C27H33 |
A2B5C27D33 |
-15.07 |
6.61 |
-8.67 |
-0.36 |
0 |
|
|
151919 |
56310745 |
1 |
O2N3C25H31 |
A2B3C25D31 |
-66.69 |
1.39 |
-8.58 |
0.12 |
0 |
|
|
151920 |
56310746 |
1 |
ClO2N4C23H25 |
AB2C4D23E25 |
-28.11 |
7.33 |
-9.22 |
-1.06 |
0 |
|
|
151921 |
56310747 |
2 |
ON2C13H16 |
AB2C13D16 |
-39.28 |
3.9 |
-8.98 |
-0.13 |
0 |
|
|
151922 |
56310748 |
1 |
SF2O2N3C22H25 |
AB2C2D3E22F25 |
-150.75 |
3.27 |
-9.22 |
-0.85 |
0 |
|
|
151923 |
56310750 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-123.89 |
2.33 |
-9.11 |
-0.49 |
0 |
|
|
151924 |
56310751 |
2 |
NO2C12H15 |
AB2C12D15 |
-123.06 |
5.95 |
-9.04 |
-0.54 |
0 |
|
|
151925 |
56310757 |
1 |
SN4O4C26H34 |
AB4C4D26E34 |
-122.09 |
5.01 |
-9.01 |
-0.14 |
0 |
|
|
151926 |
56310758 |
1 |
F2N3O3C24H29 |
A2B3C3D24E29 |
-202.31 |
4.53 |
-9.08 |
-0.16 |
0 |
|
|
151927 |
56310759 |
1 |
O3N4C24H24 |
A3B4C24D24 |
-28.95 |
5.58 |
-9.14 |
-1.06 |
0 |
|
|
151928 |
56310761 |
1 |
SN4O4C21H26 |
AB4C4D21E26 |
-121.96 |
3.63 |
-9.26 |
-0.72 |
0 |
|
|
151929 |
56310762 |
1 |
SN4O4C23H30 |
AB4C4D23E30 |
-131.55 |
6.46 |
-9.12 |
-0.65 |
0 |
|
|
151930 |
56310763 |
1 |
N4O5C22H26 |
A4B5C22D26 |
-87.03 |
4.94 |
-9.21 |
-1.26 |
0 |
|
|
151931 |
56310764 |
1 |
ClN4O4C21H23 |
AB4C4D21E23 |
-64.93 |
3.66 |
-9.33 |
-1.65 |
0 |
|
|
151932 |
56310765 |
1 |
SO2N4C26H32 |
AB2C4D26E32 |
-36.77 |
2.29 |
-8.99 |
-0.78 |
0 |
|
|
151933 |
56310766 |
1 |
O2N3C23H29 |
A2B3C23D29 |
-61.02 |
4.64 |
-8.71 |
0.15 |
0 |
|
|
151934 |
56310767 |
1 |
O2N3C24H31 |
A2B3C24D31 |
-67.03 |
2.2 |
-8.66 |
0.08 |
0 |
|
|
151935 |
56310768 |
1 |
ClO2N3C22H26 |
AB2C3D22E26 |
-58.98 |
2.05 |
-9.16 |
-0.23 |
0 |
|
|
151936 |
56310769 |
1 |
O3N4C30H34 |
A3B4C30D34 |
-73.64 |
5.73 |
-9.0 |
-0.47 |
0 |
|
|
151937 |
56310770 |
1 |
N3O4C25H27 |
A3B4C25D27 |
-123.93 |
6.05 |
-9.08 |
-1.06 |
0 |
|
|
151938 |
56310771 |
1 |
Cl2O2N3C22H25 |
A2B2C3D22E25 |
-72.3 |
1.34 |
-9.16 |
-0.6 |
0 |
|
|
151939 |
56310772 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-104.56 |
4.65 |
-9.25 |
-1.4 |
0 |
|
|
151940 |
56310773 |
1 |
SO3N4C26H28 |
AB3C4D26E28 |
-12.16 |
4.0 |
-8.86 |
-0.74 |
0 |
|
|
151941 |
56310774 |
2 |
N2O2C13H14 |
A2B2C13D14 |
-49.58 |
4.45 |
-8.82 |
-0.75 |
0 |
|
|
151942 |
56310775 |
1 |
FON3C24H26 |
ABC3D24E26 |
7.49 |
2.27 |
-8.62 |
-0.26 |
0 |
|
|
151943 |
56310776 |
1 |
FON5C20H26 |
ABC5D20E26 |
-14.92 |
5.07 |
-8.99 |
-0.21 |
0 |
|
|
151944 |
56310777 |
1 |
FON3C24H30 |
ABC3D24E30 |
-28.97 |
3.25 |
-8.68 |
-0.08 |
0 |
|
|
151945 |
56310778 |
1 |
FOSN3C21H24 |
ABCD3E21F24 |
-2.94 |
1.24 |
-8.54 |
-0.9 |
0 |
|
|
151946 |
56310779 |
1 |
FN3O3C24H32 |
AB3C3D24E32 |
-126.44 |
3.99 |
-8.41 |
-0.11 |
0 |
|
|
151947 |
56310780 |
1 |
FO4N5C25H30 |
AB4C5D25E30 |
-134.11 |
2.69 |
-8.81 |
-0.39 |
0 |
|
|
151948 |
56310781 |
1 |
FSO3N4C24H33 |
ABC3D4E24F33 |
-131.61 |
5.99 |
-8.9 |
-0.67 |
0 |
|
|
151949 |
56310782 |
1 |
FO3N5C27H32 |
AB3C5D27E32 |
-116.32 |
4.14 |
-8.62 |
-0.59 |
0 |
|
|
151950 |
56310783 |
1 |
SN2O2C23H30 |
AB2C2D23E30 |
-54.24 |
3.6 |
-8.61 |
-0.19 |
0 |
|
|
151951 |
56310784 |
1 |
SN3O3C26H29 |
AB3C3D26E29 |
-58.17 |
1.93 |
-8.28 |
-0.82 |
0 |
|
|
151952 |
56310785 |
1 |
N3O3C26H35 |
A3B3C26D35 |
-96.25 |
4.88 |
-7.9 |
0.21 |
0 |
|
|
151953 |
56310786 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-37.19 |
2.85 |
-8.6 |
-0.08 |
0 |
|
|
151954 |
56310787 |
1 |
N2O3C24H32 |
A2B3C24D32 |
-99.08 |
4.66 |
-8.39 |
0.17 |
0 |
|
|
151955 |
56310788 |
1 |
O2N3C26H29 |
A2B3C26D29 |
1.22 |
4.04 |
-8.59 |
-0.48 |
0 |
|
|
151956 |
56310789 |
1 |
ClN2O2C22H27 |
AB2C2D22E27 |
-64.96 |
4.49 |
-8.7 |
-0.17 |
0 |
|
|
151957 |
56310790 |
1 |
N2O4C23H28 |
A2B4C23D28 |
-134.72 |
4.22 |
-8.78 |
-0.72 |
0 |
|
|
151958 |
56310791 |
1 |
SN2O3C22H30 |
AB2C3D22E30 |
-84.52 |
8.84 |
-8.68 |
-0.48 |
0 |
|
|
151959 |
56310793 |
2 |
NO2C11H14 |
AB2C11D14 |
-111.49 |
4.58 |
-8.44 |
-0.24 |
0 |
|
|
151960 |
56310794 |
1 |
N3O5C21H25 |
A3B5C21D25 |
-81.84 |
8.09 |
-8.47 |
-1.25 |
0 |
|
|
151961 |
56310795 |
1 |
SO3N4C21H28 |
AB3C4D21E28 |
-87.8 |
4.25 |
-8.43 |
-0.77 |
0 |
|
|
151962 |
56310796 |
1 |
N3O4C20H23 |
A3B4C20D23 |
-45.07 |
2.5 |
-8.66 |
-1.42 |
0 |
|
|
151963 |
56310797 |
1 |
O3N4C23H32 |
A3B4C23D32 |
-96.66 |
3.22 |
-8.6 |
-0.34 |
0 |
|
|
151964 |
56310798 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-54.68 |
7.88 |
-8.6 |
-0.83 |
0 |
|
|
151965 |
56310799 |
1 |
N2O5C23H30 |
A2B5C23D30 |
-161.99 |
4.88 |
-8.43 |
-0.22 |
0 |
|
|
151966 |
56310800 |
1 |
N3O4C24H27 |
A3B4C24D27 |
-83.39 |
7.53 |
-8.36 |
-0.64 |
0 |
|
|
151967 |
56310801 |
1 |
SN5O5C23H31 |
AB5C5D23E31 |
-153.83 |
0.5 |
-8.73 |
-0.44 |
0 |
|
|
151968 |
56310802 |
1 |
BrO3N4C20H23 |
AB3C4D20E23 |
-69.47 |
3.4 |
-8.69 |
-0.74 |
0 |
|
|
151969 |
56310803 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-15.48 |
5.7 |
-8.49 |
-0.59 |
0 |
|
|
151970 |
56310804 |
2 |
N2O2C13H16 |
A2B2C13D16 |
-97.71 |
6.19 |
-8.57 |
-0.31 |
0 |
|
|
151971 |
56310805 |
1 |
O3N7C24H29 |
A3B7C24D29 |
-24.65 |
6.49 |
-8.3 |
-0.5 |
0 |
|
|
151972 |
56310806 |
1 |
N2O5C24H30 |
A2B5C24D30 |
-168.99 |
5.62 |
-8.56 |
-0.58 |
0 |
|
|
151973 |
56310807 |
1 |
N3O4C24H31 |
A3B4C24D31 |
-127.79 |
7.09 |
-8.37 |
-0.16 |
0 |
|
|
151974 |
56310808 |
1 |
FN3O3C23H28 |
AB3C3D23E28 |
-136.19 |
4.59 |
-8.59 |
-0.33 |
0 |
|
|
151975 |
56310809 |
2 |
O2N3C12H16 |
A2B3C12D16 |
-132.77 |
5.47 |
-8.61 |
-0.68 |
0 |
|
|
151976 |
56310810 |
1 |
N5O5C24H33 |
A5B5C24D33 |
-180.75 |
5.21 |
-8.58 |
-0.48 |
0 |
|
|
151977 |
56310811 |
1 |
FN3O3C22H26 |
AB3C3D22E26 |
-134.08 |
4.31 |
-8.59 |
-0.4 |
0 |
|
|
151978 |
56310813 |
1 |
F2N3O4C23H27 |
A2B3C4D23E27 |
-226.55 |
4.33 |
-8.75 |
-0.47 |
0 |
|
|
151979 |
56310814 |
1 |
N3O4C24H27 |
A3B4C24D27 |
-111.81 |
3.69 |
-8.3 |
-1.64 |
0 |
|
|
151980 |
56310815 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-132.26 |
5.69 |
-8.41 |
-0.19 |
0 |
|
|
151981 |
56310816 |
1 |
F3N3O3C22H24 |
A3B3C3D22E24 |
-242.51 |
2.49 |
-8.65 |
-0.77 |
0 |
|
|
151982 |
56310817 |
1 |
N3O3C22H27 |
A3B3C22D27 |
-85.72 |
5.78 |
-8.59 |
-0.32 |
0 |
|
|
151983 |
56310818 |
1 |
N3O4C22H33 |
A3B4C22D33 |
-167.57 |
7.37 |
-8.3 |
-0.12 |
0 |
|
|
151984 |
56310819 |
1 |
N3O5C23H27 |
A3B5C23D27 |
-165.63 |
2.73 |
-8.62 |
-0.73 |
0 |
|
|
151985 |
56310820 |
1 |
SN4O4C24H30 |
AB4C4D24E30 |
-139.55 |
2.54 |
-8.67 |
-0.63 |
0 |
|
|
151986 |
56310821 |
1 |
ClO3N4C22H23 |
AB3C4D22E23 |
-32.44 |
4.25 |
-8.6 |
-1.32 |
0 |
|
|
151987 |
56310823 |
1 |
N4O4C23H28 |
A4B4C23D28 |
-129.61 |
6.79 |
-8.64 |
-0.62 |
0 |
|
|
151988 |
56310824 |
1 |
SN3O3C23H29 |
AB3C3D23E29 |
-88.0 |
4.5 |
-8.51 |
-0.42 |
0 |