List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
162918 |
57580825 |
1 |
O3N5H29C30 |
A3B5C29D30 |
-24.6 |
8.75 |
-8.36 |
-1.05 |
0 |
|
|
162919 |
57580831 |
1 |
O3N7C28H31 |
A3B7C28D31 |
-37.99 |
4.22 |
-8.55 |
-1.26 |
0 |
|
|
162920 |
57580837 |
1 |
O2N6C25H28 |
A2B6C25D28 |
4.83 |
2.57 |
-8.45 |
-1.16 |
0 |
|
|
162921 |
57580841 |
1 |
ON4C29H32 |
AB4C29D32 |
38.64 |
7.83 |
-7.88 |
-0.82 |
0 |
|
|
162922 |
57580845 |
1 |
OF2N6C24H24 |
AB2C6D24E24 |
-41.74 |
3.4 |
-8.07 |
-0.94 |
0 |
|
|
162923 |
57580847 |
1 |
ON5C28H31 |
AB5C28D31 |
59.62 |
4.88 |
-8.0 |
-0.75 |
0 |
|
|
162924 |
57580848 |
1 |
O2N5H19C22 |
A2B5C19D22 |
36.18 |
4.02 |
-8.55 |
-1.25 |
0 |
|
|
162925 |
57580857 |
1 |
N5C23H25 |
A5B23C25 |
104.33 |
3.71 |
-7.99 |
-0.41 |
0 |
|
|
162926 |
57580863 |
2 |
ON2H12C14 |
AB2C12D14 |
38.26 |
5.75 |
-8.6 |
-1.29 |
0 |
|
|
162927 |
57580864 |
1 |
ON5C23H23 |
AB5C23D23 |
72.69 |
2.92 |
-8.38 |
-1.12 |
0 |
|
|
162929 |
57580879 |
1 |
O2N4H24C25 |
A2B4C24D25 |
25.77 |
3.51 |
-7.96 |
-0.8 |
0 |
|
|
162930 |
57580892 |
2 |
ON2C14H14 |
AB2C14D14 |
13.98 |
2.87 |
-8.94 |
-1.04 |
0 |
|
|
162931 |
57580917 |
1 |
N2C33H40 |
A2B33C40 |
35.2 |
4.13 |
-8.62 |
-0.5 |
0 |
|
|
162932 |
57580918 |
1 |
N5C32H39 |
A5B32C39 |
74.59 |
3.57 |
-7.68 |
-0.38 |
1 |
|
|
162934 |
57580924 |
1 |
NO4C27H29 |
AB4C27D29 |
-74.91 |
0.82 |
-8.49 |
0.09 |
0 |
|
|
162937 |
57580948 |
1 |
NSO6C27H27 |
ABC6D27E27 |
-149.31 |
4.48 |
-8.49 |
-0.62 |
0 |
|
|
162938 |
57580949 |
1 |
NS2O8H25C26 |
AB2C8D25E26 |
-229.68 |
3.32 |
-8.53 |
-1.42 |
0 |
|
|
162939 |
57580950 |
1 |
NO5C22H23 |
AB5C22D23 |
-137.52 |
2.88 |
-8.64 |
-0.27 |
0 |
|
|
162940 |
57580951 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-98.41 |
4.8 |
-8.53 |
0.01 |
1 |
|
|
162941 |
57580956 |
1 |
SN2O6H19C26 |
AB2C6D19E26 |
-85.85 |
1.4 |
0.0 |
0.0 |
-1 |
|
|
162944 |
57580973 |
1 |
NO6H25C27 |
AB6C25D27 |
-150.21 |
2.86 |
-8.52 |
-0.51 |
0 |
|
|
162945 |
57580975 |
1 |
SO6H26C27 |
AB6C26D27 |
-172.32 |
3.02 |
-8.42 |
-0.53 |
0 |
|
|
162946 |
57580979 |
1 |
NSF2O6H21C25 |
ABC2D6E21F25 |
-243.06 |
5.21 |
-8.27 |
-1.51 |
0 |
|
|
162948 |
57580981 |
1 |
SN3O6C30H37 |
AB3C6D30E37 |
-200.87 |
5.09 |
-8.54 |
-0.16 |
0 |
|
|
162949 |
57580983 |
1 |
NO4C21H27 |
AB4C21D27 |
-105.94 |
0.87 |
-8.06 |
0.28 |
1 |
|
|
162950 |
57580984 |
1 |
NO5H22C23 |
AB5C22D23 |
-123.26 |
3.65 |
0.0 |
0.0 |
0 |
|
|
162951 |
57580993 |
1 |
FNSO6H22C25 |
ABCD6E22F25 |
-196.33 |
5.46 |
-8.4 |
-1.04 |
0 |
|
|
162952 |
57580997 |
1 |
NSO7H25C26 |
ABC7D25E26 |
-191.93 |
6.81 |
-8.41 |
-0.84 |
0 |
|
|
162953 |
57581002 |
1 |
NO5C21H23 |
AB5C21D23 |
-142.82 |
2.05 |
-8.66 |
-0.12 |
-1 |
|
|
162954 |
57581009 |
1 |
SN2O8H23C25 |
AB2C8D23E25 |
-128.69 |
4.24 |
0.0 |
0.0 |
0 |
|
|
162956 |
57581016 |
1 |
NO4C19H21 |
AB4C19D21 |
-103.8 |
2.12 |
-8.37 |
-0.23 |
-1 |
|
|
162957 |
57581032 |
1 |
NORhC14H18 |
ABCD14E18 |
26.04 |
16.04 |
-10.52 |
-3.55 |
0 |
|
|
162958 |
57581034 |
1 |
NPC4H9 |
ABC4D9 |
17.05 |
2.6 |
0.0 |
0.0 |
0 |
|
|
162959 |
57581035 |
1 |
OPN2C14H19 |
ABC2D14E19 |
2.71 |
3.46 |
-8.61 |
-0.12 |
0 |
|
|
162960 |
57581036 |
1 |
NO3C14H17 |
AB3C14D17 |
-66.9 |
4.23 |
-8.77 |
-0.4 |
0 |
|
|
162961 |
57581038 |
1 |
NO5C14H17 |
AB5C14D17 |
-134.06 |
2.52 |
-8.47 |
-0.65 |
0 |
|
|
162963 |
57581056 |
1 |
NOC15H19 |
ABC15D19 |
-14.15 |
4.7 |
-8.98 |
-0.25 |
0 |
|
|
162964 |
57581059 |
1 |
N2O4F7C29H31 |
A2B4C7D29E31 |
-508.87 |
3.24 |
-9.44 |
-1.22 |
0 |
|
|
162965 |
57581060 |
2 |
OC4H6 |
AB4C6 |
-79.99 |
4.74 |
-9.73 |
-0.41 |
0 |
|
|
162967 |
57581066 |
1 |
NO4F6C26H27 |
AB4C6D26E27 |
-465.79 |
2.3 |
-9.59 |
-1.23 |
0 |
|
|
162968 |
57581078 |
1 |
N4O4F6H26C27 |
A4B4C6D26E27 |
-401.71 |
5.19 |
-9.44 |
-1.3 |
0 |
|
|
162969 |
57581079 |
1 |
NO5F7C28H28 |
AB5C7D28E28 |
-556.39 |
3.5 |
-9.68 |
-1.25 |
0 |
|
|
162970 |
57581082 |
1 |
N2O3F6C30H32 |
A2B3C6D30E32 |
-400.89 |
5.28 |
-8.89 |
-1.27 |
0 |
|
|
162971 |
57581090 |
1 |
N2O3F7H29C30 |
A2B3C7D29E30 |
-434.37 |
4.65 |
-8.37 |
-1.22 |
0 |
|
|
162972 |
57581093 |
1 |
O2N3F7H26C28 |
A2B3C7D26E28 |
-385.23 |
4.72 |
-8.94 |
-1.21 |
0 |
|
|
162974 |
57581115 |
1 |
ON7C23H25 |
AB7C23D25 |
94.02 |
5.65 |
-8.51 |
-1.06 |
0 |
|
|
162975 |
57581116 |
1 |
ON8H26C28 |
AB8C26D28 |
167.17 |
3.29 |
-8.56 |
-2.04 |
0 |
|
|
162976 |
57581158 |
1 |
ClN3H6C9 |
AB3C6D9 |
96.87 |
3.72 |
-9.21 |
-0.84 |
0 |
|
|
162977 |
57581160 |
1 |
ClN3H8C10 |
AB3C8D10 |
86.59 |
3.83 |
-9.19 |
-0.86 |
0 |
|
|
162978 |
57581163 |
1 |
KP13H14 |
AB13C14 |
-161.08 |
9.26 |
-6.86 |
0.24 |
0 |