List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
326974 |
126688784 |
4 |
NO3C14H19 |
AB3C14D19 |
-473.4 |
2.67 |
-8.0 |
-0.79 |
0 |
|
|
326975 |
126688785 |
1 |
ClSO4N7C17H22 |
ABC4D7E17F22 |
-60.33 |
1.68 |
-8.44 |
-0.43 |
0 |
|
|
326976 |
126688786 |
2 |
NaSN2O7C26H36 |
ABC2D7E26F36 |
-464.42 |
7.14 |
-4.63 |
-0.71 |
0 |
|
|
326977 |
126688787 |
2 |
N2O6C25H32 |
A2B6C25D32 |
-430.28 |
10.26 |
-8.16 |
-0.76 |
0 |
|
|
326978 |
126688788 |
1 |
NaSC2F2H3O3 |
ABC2D2E3F3 |
-275.9 |
7.46 |
-10.36 |
0.31 |
0 |
|
|
326979 |
126688789 |
2 |
NaSN2O7C26H35 |
ABC2D7E26F35 |
-578.43 |
39.27 |
-8.21 |
-1.46 |
0 |
|
|
326980 |
126688790 |
2 |
SN2O7C26H36 |
AB2C7D26E36 |
-537.24 |
7.89 |
-8.18 |
-0.65 |
0 |
|
|
326981 |
126688792 |
2 |
N3O6C30H43 |
A3B6C30D43 |
-482.42 |
3.02 |
-7.97 |
-0.76 |
0 |
|
|
326982 |
126688794 |
2 |
SO6C24H30 |
AB6C24D30 |
-401.43 |
5.38 |
-8.0 |
-0.65 |
0 |
|
|
326983 |
126688795 |
2 |
SO6C24H30 |
AB6C24D30 |
-389.63 |
5.43 |
-7.91 |
-1.79 |
0 |
|
|
326984 |
126688798 |
2 |
N2O6C39H56 |
A2B6C39D56 |
-563.49 |
6.29 |
-8.05 |
-0.63 |
0 |
|
|
326985 |
126688800 |
4 |
NO3C16H22 |
AB3C16D22 |
-488.66 |
9.65 |
-8.21 |
-0.58 |
0 |
|
|
326986 |
126688801 |
1 |
OSH8C9 |
ABC8D9 |
10.43 |
0.45 |
-8.59 |
-0.41 |
0 |
|
|
326987 |
126688802 |
1 |
O2C11H18 |
A2B11C18 |
-45.97 |
5.04 |
-8.89 |
-0.64 |
0 |
|
|
326988 |
126688803 |
2 |
NC5H6 |
AB5C6 |
40.3 |
3.74 |
-8.14 |
0.37 |
0 |
|
|
326989 |
126688806 |
1 |
N3O3C10H15 |
A3B3C10D15 |
-113.69 |
6.23 |
-9.89 |
-0.5 |
0 |
|
|
326990 |
126688808 |
1 |
O3F4N5C28H29 |
A3B4C5D28E29 |
-237.44 |
7.06 |
-9.22 |
-0.88 |
0 |
|
|
326991 |
126688809 |
2 |
NSO6C23H31 |
ABC6D23E31 |
-438.03 |
1.86 |
-8.06 |
-0.79 |
0 |
|
|
326992 |
126688810 |
1 |
N4S4O13C56H80 |
A4B4C13D56E80 |
-484.06 |
6.3 |
-7.93 |
-0.95 |
0 |
|
|
326993 |
126688811 |
1 |
ClSO5N8C18H25 |
ABC5D8E18F25 |
-115.84 |
5.83 |
-8.51 |
-0.41 |
0 |
|
|
326994 |
126688812 |
1 |
NNaSO3C5H8 |
ABCD3E5F8 |
-156.41 |
7.97 |
-10.24 |
0.32 |
0 |
|
|
326995 |
126688814 |
1 |
ClSF3O4N7C18H23 |
ABC3D4E7F18G23 |
-238.32 |
2.55 |
-8.47 |
-0.43 |
0 |
|
|
326996 |
126688815 |
1 |
O3F4N5C28H31 |
A3B4C5D28E31 |
-244.12 |
7.1 |
-9.14 |
-1.13 |
0 |
|
|
326997 |
126688816 |
1 |
FSO3C5H9 |
ABC3D5E9 |
-181.79 |
3.68 |
-11.7 |
-0.06 |
0 |
|
|
326998 |
126688817 |
1 |
ClSO4N7C18H26 |
ABC4D7E18F26 |
-99.93 |
1.71 |
-8.35 |
-0.35 |
0 |
|
|
326999 |
126688820 |
1 |
ClSO4N7C18H26 |
ABC4D7E18F26 |
-99.98 |
5.33 |
-8.42 |
-0.46 |
0 |
|
|
327000 |
126688821 |
1 |
NSO4C9H19 |
ABC4D9E19 |
-160.05 |
14.7 |
-9.4 |
-0.28 |
0 |
|
|
327001 |
126688833 |
1 |
OF3N5H28C32 |
AB3C5D28E32 |
-15.82 |
4.26 |
-9.16 |
-1.45 |
0 |
|
|
327002 |
126688834 |
1 |
FSN3O3C23H30 |
ABC3D3E23F30 |
-107.75 |
5.04 |
-8.25 |
-0.48 |
0 |
|
|
327003 |
126688836 |
1 |
N3O6C23H31 |
A3B6C23D31 |
-268.39 |
3.08 |
-9.24 |
-0.01 |
0 |
|
|
327004 |
126688838 |
1 |
NSO4C7H15 |
ABC4D7E15 |
-169.12 |
2.64 |
-9.01 |
-0.54 |
0 |
|
|
327005 |
126688840 |
1 |
NSO4C7H15 |
ABC4D7E15 |
-166.48 |
5.02 |
-9.21 |
-0.21 |
0 |
|
|
327006 |
126688841 |
1 |
NSO4C7H15 |
ABC4D7E15 |
-155.86 |
8.56 |
-10.09 |
-0.58 |
0 |
|
|
327007 |
126688844 |
1 |
NSO6C20H41 |
ABC6D20E41 |
-307.73 |
13.8 |
-10.18 |
-0.44 |
0 |
|
|
327008 |
126688847 |
2 |
N2O6C29H40 |
A2B6C29D40 |
-483.19 |
6.06 |
-8.07 |
-0.61 |
0 |
|
|
327009 |
126688849 |
1 |
NSO5C9H19 |
ABC5D9E19 |
-225.58 |
5.3 |
-9.38 |
-0.41 |
0 |
|
|
327010 |
126688851 |
1 |
NSO5C9H19 |
ABC5D9E19 |
-214.34 |
4.15 |
-9.48 |
-0.47 |
0 |
|
|
327011 |
126688853 |
2 |
N2O6C37H56 |
A2B6C37D56 |
-580.45 |
13.1 |
-7.96 |
-0.45 |
0 |
|
|
327012 |
126688860 |
2 |
N2O8C29H38 |
A2B8C29D38 |
-637.74 |
6.96 |
-8.05 |
-0.83 |
0 |
|
|
327013 |
126688862 |
4 |
NO3C13H17 |
AB3C13D17 |
-442.97 |
5.31 |
-8.05 |
-0.59 |
0 |
|
|
327014 |
126688865 |
1 |
ClFON4H16C17 |
ABCD4E16F17 |
-23.43 |
6.95 |
-8.31 |
-0.93 |
0 |
|
|
327015 |
126688867 |
2 |
NNaSO6C23H30 |
ABCD6E23F30 |
-364.88 |
50.4 |
-7.96 |
-2.03 |
0 |
|
|
327016 |
126688868 |
2 |
NSO6C23H31 |
ABC6D23E31 |
-436.34 |
10.92 |
-8.37 |
-0.52 |
0 |
|
|
327017 |
126688869 |
1 |
N3H15C17 |
A3B15C17 |
73.66 |
0.54 |
-8.57 |
-1.08 |
0 |
|
|
327019 |
126688873 |
1 |
NOC13H15 |
ABC13D15 |
90.07 |
0.28 |
-9.5 |
0.07 |
0 |
|
|
327020 |
126688875 |
1 |
ClFON5C19H21 |
ABCD5E19F21 |
-17.08 |
8.93 |
-8.37 |
-0.88 |
0 |
|
|
327021 |
126688876 |
2 |
SN3O3C9H10 |
AB3C3D9E10 |
-107.25 |
3.1 |
-8.81 |
-1.07 |
0 |
|
|
327022 |
126688877 |
1 |
AuCPSN2H5 |
ABCDE2F5 |
103.4 |
3.15 |
0.0 |
0.0 |
0 |
|
|
327023 |
126688879 |
1 |
SF3N5O6H14C17 |
AB3C5D6E14F17 |
-269.4 |
6.36 |
-9.82 |
-1.51 |
0 |
|
|
327024 |
126688881 |
1 |
ON2C18H28 |
AB2C18D28 |
-49.73 |
3.83 |
-8.85 |
0.49 |
0 |
|
|
327025 |
126688882 |
1 |
FSO5N6C19H19 |
ABC5D6E19F19 |
-123.41 |
4.87 |
-8.83 |
-1.11 |
0 |
|
|
327026 |
126688883 |
1 |
SN5O6C18H19 |
AB5C6D18E19 |
-119.77 |
4.64 |
-9.35 |
-1.18 |
0 |
|
|
327027 |
126688885 |
1 |
OF4N5H27C32 |
AB4C5D27E32 |
-81.84 |
2.91 |
-8.94 |
-1.38 |
0 |
|
|
327028 |
126688889 |
1 |
SN5O5C11H13 |
AB5C5D11E13 |
-106.04 |
4.32 |
-9.86 |
-0.96 |
0 |
|
|
327029 |
126688890 |
1 |
O2F3N4H21C33 |
A2B3C4D21E33 |
-57.53 |
4.79 |
-8.94 |
-1.49 |
0 |
|
|
327030 |
126688891 |
1 |
SO4N7C20H23 |
AB4C7D20E23 |
-55.87 |
2.08 |
-8.81 |
-0.38 |
0 |
|
|
327031 |
126688894 |
1 |
SF3N5O6H14C19 |
AB3C5D6E14F19 |
-210.96 |
5.82 |
-9.65 |
-1.63 |
0 |
|
|
327032 |
126688895 |
1 |
F4N5O6C40H45 |
A4B5C6D40E45 |
-374.15 |
8.1 |
-8.87 |
-0.97 |
0 |
|
|
327033 |
126688897 |
1 |
OF4N6H28C30 |
AB4C6D28E30 |
-82.72 |
5.19 |
-9.06 |
-0.91 |
0 |
|
|
327034 |
126688899 |
1 |
N4O12C35H44 |
A4B12C35D44 |
-486.61 |
3.95 |
-8.67 |
-1.34 |
0 |
|
|
327035 |
126688900 |
1 |
S3N7O14C45H59 |
A3B7C14D45E59 |
-548.2 |
6.75 |
-8.29 |
-0.96 |
0 |
|
|
327036 |
126688902 |
1 |
O14C27H34 |
A14B27C34 |
-597.54 |
0.6 |
-9.7 |
-0.27 |
0 |
|
|
327037 |
126688903 |
1 |
O14C27H34 |
A14B27C34 |
-595.97 |
6.43 |
-9.4 |
-0.14 |
0 |
|
|
327038 |
126688906 |
1 |
O8C11H16 |
A8B11C16 |
-361.78 |
7.13 |
-10.7 |
-0.26 |
0 |
|
|
327039 |
126688908 |
3 |
O2C5H6 |
A2B5C6 |
-245.98 |
2.87 |
-9.68 |
-0.09 |
0 |
|
|
327040 |
126688909 |
3 |
O2C5H6 |
A2B5C6 |
-247.2 |
3.3 |
-9.81 |
-0.15 |
0 |
|
|
327041 |
126688911 |
1 |
O5N7C34H49 |
A5B7C34D49 |
-142.11 |
5.37 |
-8.14 |
-0.04 |
0 |
|
|
327042 |
126688912 |
1 |
NO3C21H29 |
AB3C21D29 |
-110.93 |
2.77 |
-8.35 |
0.07 |
0 |
|
|
327043 |
126688913 |
1 |
F3N4O4C33H33 |
A3B4C4D33E33 |
-198.24 |
6.27 |
-8.66 |
-1.35 |
0 |
|
|
327044 |
126688914 |
1 |
N2S3O6C13H20 |
A2B3C6D13E20 |
-227.89 |
10.16 |
-8.63 |
-0.64 |
0 |
|
|
327045 |
126688915 |
2 |
O5C7H10 |
A5B7C10 |
-447.53 |
5.68 |
-11.0 |
-0.34 |
0 |
|
|
327046 |
126688916 |
2 |
O5C7H10 |
A5B7C10 |
-446.5 |
7.57 |
-10.9 |
-0.34 |
0 |
|
|
327047 |
126688917 |
1 |
S3N7O16C49H67 |
A3B7C16D49E67 |
-642.69 |
12.01 |
-8.31 |
-1.59 |
0 |
|
|
327048 |
126688918 |
1 |
O18C49H74 |
A18B49C74 |
-851.57 |
3.17 |
-9.52 |
-0.19 |
0 |
|
|
327049 |
126688920 |
1 |
N5O5C26H33 |
A5B5C26D33 |
-195.88 |
9.68 |
-8.61 |
-1.29 |
0 |