List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
430881 |
135170948 |
1 |
FON4C25H37 |
ABC4D25E37 |
-51.2 |
3.7 |
-8.54 |
0.23 |
0 |
|
|
430882 |
135170949 |
1 |
FON4C25H37 |
ABC4D25E37 |
-56.82 |
1.22 |
-8.87 |
0.09 |
0 |
|
|
430883 |
135170950 |
1 |
ON4C23H28 |
AB4C23D28 |
10.5 |
3.77 |
-8.65 |
-0.35 |
0 |
|
|
430884 |
135170951 |
1 |
O2N5C24H27 |
A2B5C24D27 |
7.27 |
3.38 |
-9.24 |
-0.67 |
0 |
|
|
430885 |
135170952 |
1 |
ON4C23H28 |
AB4C23D28 |
14.46 |
2.12 |
-8.83 |
-0.53 |
0 |
|
|
430886 |
135170953 |
1 |
ON5C24H27 |
AB5C24D27 |
48.23 |
2.61 |
-9.08 |
-1.26 |
0 |
|
|
430887 |
135170954 |
2 |
ON3C11H14 |
AB3C11D14 |
19.7 |
2.64 |
-9.27 |
-0.71 |
0 |
|
|
430888 |
135170955 |
1 |
ON3F4C24H25 |
AB3C4D24E25 |
-197.97 |
3.03 |
-8.89 |
-0.65 |
0 |
|
|
430889 |
135170956 |
1 |
ON3F4C24H25 |
AB3C4D24E25 |
-199.3 |
4.3 |
-8.88 |
-0.6 |
0 |
|
|
430890 |
135170957 |
1 |
SO3N4C24H30 |
AB3C4D24E30 |
-66.25 |
7.78 |
-8.87 |
-1.12 |
0 |
|
|
430891 |
135170958 |
1 |
SO2N4C24H30 |
AB2C4D24E30 |
-9.59 |
5.12 |
-8.51 |
-0.84 |
0 |
|
|
430892 |
135170960 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-72.37 |
4.65 |
-8.73 |
-0.4 |
0 |
|
|
430893 |
135170961 |
1 |
ON3C27H33 |
AB3C27D33 |
21.29 |
5.16 |
-8.62 |
-0.16 |
0 |
|
|
430894 |
135170962 |
1 |
ON3C27H33 |
AB3C27D33 |
16.68 |
4.69 |
-8.62 |
-0.15 |
0 |
|
|
430895 |
135170963 |
1 |
FO3N4C21H29 |
AB3C4D21E29 |
-176.63 |
3.52 |
-9.4 |
-0.9 |
0 |
|
|
430896 |
135170964 |
1 |
OSN2C16H20 |
ABC2D16E20 |
-13.21 |
2.78 |
-8.7 |
-0.21 |
0 |
|
|
430897 |
135170965 |
1 |
FON5C24H26 |
ABC5D24E26 |
-0.79 |
5.15 |
-9.15 |
-1.28 |
0 |
|
|
430898 |
135170966 |
1 |
N2O4C9H14 |
A2B4C9D14 |
-160.87 |
7.05 |
-9.81 |
-0.75 |
0 |
|
|
430899 |
135170967 |
1 |
ON3F4C24H25 |
AB3C4D24E25 |
-199.09 |
5.05 |
-8.88 |
-0.63 |
0 |
|
|
430900 |
135170968 |
1 |
O2N5C27H29 |
A2B5C27D29 |
22.72 |
5.13 |
-8.75 |
-1.26 |
0 |
|
|
430901 |
135170969 |
1 |
ON2C22H28 |
AB2C22D28 |
-7.74 |
5.9 |
-8.98 |
0.0 |
0 |
|
|
430902 |
135170970 |
1 |
ON5C23H29 |
AB5C23D29 |
14.54 |
3.87 |
-8.48 |
-0.57 |
0 |
|
|
430903 |
135170971 |
1 |
O2F3N3C25H28 |
A2B3C3D25E28 |
-199.56 |
2.02 |
-8.73 |
-0.39 |
0 |
|
|
430904 |
135170974 |
2 |
ON2C12H15 |
AB2C12D15 |
3.98 |
4.45 |
-8.62 |
-0.5 |
0 |
|
|
430905 |
135170975 |
1 |
ON2C22H26 |
AB2C22D26 |
6.82 |
4.33 |
-8.36 |
0.0 |
0 |
|
|
430906 |
135170976 |
1 |
ON3C24H29 |
AB3C24D29 |
5.26 |
1.98 |
-8.71 |
-0.46 |
0 |
|
|
430907 |
135170977 |
1 |
OSN6C20H26 |
ABC6D20E26 |
34.02 |
6.43 |
-9.31 |
-0.68 |
0 |
|
|
430908 |
135170978 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-155.76 |
4.98 |
-9.51 |
-0.15 |
0 |
|
|
430909 |
135170979 |
1 |
ON4C25H30 |
AB4C25D30 |
36.91 |
1.89 |
-9.09 |
-0.63 |
0 |
|
|
430910 |
135170980 |
2 |
NOC10H15 |
ABC10D15 |
-92.53 |
3.25 |
-9.15 |
0.13 |
0 |
|
|
430911 |
135170981 |
2 |
NOC11H17 |
ABC11D17 |
-94.82 |
2.15 |
-8.9 |
0.31 |
0 |
|
|
430912 |
135170982 |
1 |
N2C17H26 |
A2B17C26 |
19.58 |
1.07 |
-8.7 |
0.25 |
0 |
|
|
430913 |
135170983 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-155.61 |
3.54 |
-9.34 |
-0.07 |
0 |
|
|
430914 |
135170984 |
1 |
FON5C24H26 |
ABC5D24E26 |
-1.73 |
5.62 |
-9.2 |
-0.93 |
0 |
|
|
430915 |
135170985 |
1 |
OF3N4C24H27 |
AB3C4D24E27 |
-147.68 |
3.73 |
-9.01 |
-1.32 |
0 |
|
|
430916 |
135170986 |
1 |
OF3N4C24H27 |
AB3C4D24E27 |
-146.5 |
5.78 |
-9.18 |
-1.19 |
0 |
|
|
430917 |
135170987 |
1 |
FON4C16H21 |
ABC4D16E21 |
-57.32 |
3.74 |
-9.06 |
-0.92 |
0 |
|
|
430918 |
135170988 |
1 |
FO2N5C23H28 |
AB2C5D23E28 |
-14.36 |
3.43 |
-9.38 |
-0.8 |
0 |
|
|
430919 |
135170989 |
2 |
ON2C11H13 |
AB2C11D13 |
13.05 |
4.55 |
-8.86 |
-0.54 |
0 |
|
|
430920 |
135170990 |
2 |
ON2C11H14 |
AB2C11D14 |
-5.29 |
4.29 |
-8.78 |
-0.44 |
0 |
|
|
430921 |
135170991 |
1 |
FON3C24H28 |
ABC3D24E28 |
-43.4 |
5.05 |
-8.9 |
-0.63 |
0 |
|
|
430922 |
135170992 |
1 |
FSN4O5C20H25 |
ABC4D5E20F25 |
-182.83 |
3.32 |
-8.68 |
-0.72 |
0 |
|
|
430923 |
135170993 |
1 |
ClSN4O5C18H21 |
ABC4D5E18F21 |
-138.57 |
1.97 |
-8.8 |
-0.98 |
0 |
|
|
430924 |
135170994 |
1 |
O3N5C22H27 |
A3B5C22D27 |
14.01 |
2.32 |
-8.74 |
-0.98 |
0 |
|
|
430925 |
135170995 |
1 |
O2N5C26H31 |
A2B5C26D31 |
33.9 |
4.04 |
-8.18 |
-0.22 |
0 |
|
|
430926 |
135170996 |
1 |
O2N5C26H31 |
A2B5C26D31 |
29.56 |
2.2 |
-8.36 |
-0.47 |
0 |
|
|
430927 |
135170997 |
2 |
NOC7H7 |
ABC7D7 |
91.67 |
4.66 |
-9.46 |
-1.12 |
0 |
|
|
430928 |
135170998 |
2 |
NOC7H9 |
ABC7D9 |
-5.19 |
4.04 |
-9.51 |
-0.71 |
0 |
|
|
430929 |
135170999 |
1 |
O2F3N4C26H31 |
A2B3C4D26E31 |
-192.28 |
1.52 |
-8.64 |
-0.93 |
0 |
|
|
430930 |
135171000 |
1 |
O2N3C25H29 |
A2B3C25D29 |
-18.76 |
3.75 |
-8.43 |
-0.32 |
0 |
|
|
430931 |
135171001 |
1 |
ClSO3N5H20C21 |
ABC3D5E20F21 |
-16.36 |
4.04 |
-8.56 |
-0.75 |
0 |
|
|
430932 |
135171002 |
1 |
O2N5C31H37 |
A2B5C31D37 |
100.04 |
4.38 |
-8.75 |
-0.72 |
0 |
|
|
430933 |
135171003 |
1 |
SO2F4N4C26H30 |
AB2C4D4E26F30 |
-223.18 |
4.8 |
-8.24 |
-1.19 |
0 |
|
|
430934 |
135171004 |
1 |
O2N4C25H34 |
A2B4C25D34 |
1.99 |
5.57 |
-8.55 |
-0.98 |
0 |
|
|
430935 |
135171005 |
2 |
ON2C11H16 |
AB2C11D16 |
-48.76 |
6.49 |
-8.79 |
0.11 |
0 |
|
|
430936 |
135171006 |
2 |
ON3C10H13 |
AB3C10D13 |
-2.29 |
2.84 |
-9.18 |
-0.73 |
0 |
|
|
430937 |
135171007 |
1 |
ON4C21H34 |
AB4C21D34 |
-11.81 |
4.77 |
-7.95 |
-0.05 |
0 |
|
|
430938 |
135171008 |
1 |
BrNOC7H12 |
ABCD7E12 |
-11.82 |
2.12 |
-8.9 |
-0.78 |
0 |
|
|
430939 |
135171009 |
1 |
SO2N3C25H33 |
AB2C3D25E33 |
0.96 |
4.8 |
-8.14 |
-0.63 |
0 |
|
|
430940 |
135171010 |
1 |
OSN3C25H33 |
ABC3D25E33 |
24.56 |
2.93 |
-8.34 |
-0.8 |
0 |
|
|
430941 |
135171011 |
1 |
ON3C26H31 |
AB3C26D31 |
3.11 |
4.1 |
-8.67 |
-0.32 |
0 |
|
|
430942 |
135171012 |
1 |
ON4C23H28 |
AB4C23D28 |
14.68 |
2.73 |
-8.74 |
-0.44 |
0 |
|
|
430943 |
135171013 |
1 |
ION4C20H31 |
ABC4D20E31 |
-0.46 |
2.15 |
-8.37 |
-2.01 |
0 |
|
|
430944 |
135171014 |
1 |
O2F3N4C24H27 |
A2B3C4D24E27 |
-189.47 |
4.16 |
-9.22 |
-1.16 |
0 |
|
|
430945 |
135171015 |
1 |
ON3C25H31 |
AB3C25D31 |
5.47 |
3.92 |
-8.73 |
-0.33 |
0 |
|
|
430946 |
135171016 |
1 |
ON5C25H33 |
AB5C25D33 |
79.17 |
3.8 |
-8.75 |
-1.27 |
0 |
|
|
430947 |
135171017 |
1 |
O3N6C26H30 |
A3B6C26D30 |
-28.95 |
1.51 |
-8.71 |
-1.01 |
0 |
|
|
430948 |
135171018 |
1 |
ON5C26H37 |
AB5C26D37 |
69.61 |
6.48 |
-8.76 |
-1.2 |
0 |
|
|
430949 |
135171019 |
1 |
OF3N3C24H26 |
AB3C3D24E26 |
-151.39 |
1.91 |
-8.91 |
-0.65 |
0 |
|
|
430950 |
135171020 |
1 |
ON4C25H32 |
AB4C25D32 |
-3.74 |
6.76 |
-8.29 |
-0.1 |
0 |
|
|
430951 |
135171021 |
1 |
ON3C22H31 |
AB3C22D31 |
-7.37 |
3.5 |
-8.73 |
-0.38 |
0 |
|
|
430952 |
135171022 |
1 |
ON4C25H32 |
AB4C25D32 |
-5.18 |
5.71 |
-8.22 |
-0.27 |
0 |
|
|
430953 |
135171023 |
1 |
FON3C24H28 |
ABC3D24E28 |
-43.65 |
3.04 |
-8.73 |
-0.35 |
0 |
|
|
430954 |
135171024 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-137.75 |
3.45 |
-8.71 |
-0.28 |
0 |
|
|
430955 |
135171025 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-25.94 |
3.47 |
-8.85 |
-0.47 |
0 |
|
|
430956 |
135171026 |
1 |
ON5C22H25 |
AB5C22D25 |
46.93 |
5.2 |
-8.73 |
-0.69 |
0 |
|
|
430957 |
135171027 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-25.74 |
3.37 |
-8.86 |
-0.47 |
0 |
|
|
430958 |
135171028 |
1 |
OF3N5C23H26 |
AB3C5D23E26 |
-127.84 |
1.63 |
-8.8 |
-1.07 |
0 |
|
|
430959 |
135171029 |
1 |
FON3C24H28 |
ABC3D24E28 |
-42.83 |
4.79 |
-8.76 |
-0.23 |
0 |
|
|
430960 |
135171030 |
1 |
FO2N4C24H33 |
AB2C4D24E33 |
-76.31 |
3.04 |
-8.56 |
-0.34 |
0 |
|
|
430961 |
135171031 |
1 |
FO2N4C23H33 |
AB2C4D23E33 |
-100.37 |
0.91 |
-8.58 |
0.02 |
0 |
|
|
430962 |
135171032 |
1 |
ON6C24H28 |
AB6C24D28 |
52.26 |
5.22 |
-8.5 |
-0.68 |
0 |
|
|
430963 |
135171033 |
1 |
ClO2N4C20H25 |
AB2C4D20E25 |
-48.85 |
5.98 |
-8.24 |
-0.63 |
0 |
|
|
430964 |
135171034 |
1 |
ClN3O3C21H24 |
AB3C3D21E24 |
-89.82 |
2.38 |
-9.34 |
-0.77 |
0 |
|
|
430965 |
135171035 |
1 |
ClN3O3C21H24 |
AB3C3D21E24 |
-85.01 |
8.93 |
-9.01 |
-0.7 |
0 |
|
|
430966 |
135171036 |
1 |
ON6C24H28 |
AB6C24D28 |
50.32 |
6.28 |
-8.45 |
-0.73 |
0 |
|
|
430967 |
135171037 |
1 |
ClON3C24H28 |
ABC3D24E28 |
-3.48 |
3.45 |
-8.63 |
-0.33 |
0 |
|
|
430968 |
135171038 |
1 |
ClON3C24H26 |
ABC3D24E26 |
13.98 |
2.52 |
-8.56 |
-0.56 |
0 |
|
|
430969 |
135171039 |
2 |
ON2C12H15 |
AB2C12D15 |
-23.51 |
2.69 |
-8.58 |
-0.42 |
0 |
|
|
430970 |
135171040 |
2 |
NOC8H10 |
ABC8D10 |
-56.73 |
2.53 |
-8.76 |
-0.41 |
0 |
|
|
430971 |
135171041 |
2 |
ON2C12H15 |
AB2C12D15 |
-24.69 |
4.02 |
-8.59 |
-0.51 |
0 |
|
|
430972 |
135171042 |
1 |
ClO2N5C19H22 |
AB2C5D19E22 |
-0.03 |
8.13 |
-8.52 |
-0.63 |
0 |
|
|
430973 |
135171043 |
2 |
ON3C12H15 |
AB3C12D15 |
18.37 |
5.56 |
-8.67 |
-0.72 |
0 |
|
|
430974 |
135171044 |
1 |
ClON2C19H25 |
ABC2D19E25 |
14.28 |
1.88 |
-8.53 |
-0.72 |
0 |
|
|
430975 |
135171045 |
1 |
ClO3N4C19H21 |
AB3C4D19E21 |
-71.2 |
9.12 |
-9.26 |
-0.71 |
0 |
|
|
430976 |
135171046 |
1 |
NO2C14H15 |
AB2C14D15 |
-46.7 |
6.4 |
-9.15 |
-0.16 |
0 |
|
|
430977 |
135171047 |
1 |
NO4C19H27 |
AB4C19D27 |
-189.42 |
1.09 |
-9.14 |
0.28 |
0 |
|
|
430978 |
135171048 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-172.48 |
1.53 |
-8.94 |
0.75 |
0 |
|
|
430979 |
135171049 |
1 |
NO4C19H23 |
AB4C19D23 |
-149.66 |
7.4 |
-9.45 |
-0.41 |
0 |
|
|
430980 |
135171050 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-89.91 |
4.13 |
-8.81 |
-0.96 |
0 |