List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
300933 |
123055423 |
1 |
NCl2O6H21C27 |
AB2C6D21E27 |
-166.25 |
9.25 |
-9.15 |
-1.14 |
0 |
|
|
300934 |
123055424 |
1 |
NCl2O6H23C28 |
AB2C6D23E28 |
-172.39 |
5.89 |
-9.15 |
-1.12 |
0 |
|
|
300935 |
123055425 |
1 |
NCl2O6H21C27 |
AB2C6D21E27 |
-164.22 |
8.6 |
-9.04 |
-1.07 |
0 |
|
|
300936 |
123055426 |
1 |
NCl2O6H23C28 |
AB2C6D23E28 |
-169.37 |
7.1 |
-9.09 |
-1.08 |
0 |
|
|
300937 |
123055428 |
1 |
NCl3O4H20C26 |
AB3C4D20E26 |
-96.15 |
7.62 |
-9.21 |
-0.97 |
0 |
|
|
300938 |
123055429 |
1 |
NCl2F3O4H18C26 |
AB2C3D4E18F26 |
-242.91 |
7.9 |
-9.19 |
-1.11 |
0 |
|
|
300939 |
123055431 |
1 |
NCl2O5H21C26 |
AB2C5D21E26 |
-119.49 |
6.68 |
-8.27 |
-0.92 |
0 |
|
|
300940 |
123055432 |
1 |
NCl2O4H23C27 |
AB2C4D23E27 |
-98.6 |
5.89 |
-8.47 |
-0.88 |
0 |
|
|
300941 |
123055433 |
1 |
NCl2O5H23C27 |
AB2C5D23E27 |
-124.71 |
4.44 |
-8.31 |
-0.91 |
0 |
|
|
300942 |
123055437 |
1 |
NCl3O4H18C25 |
AB3C4D18E25 |
-90.16 |
8.42 |
-8.8 |
-1.08 |
0 |
|
|
300943 |
123055439 |
1 |
SCl2N2O6H20C25 |
AB2C2D6E20F25 |
-157.09 |
12.27 |
-9.4 |
-1.24 |
0 |
|
|
300944 |
123055440 |
1 |
Cl2N2O5H22C27 |
A2B2C5D22E27 |
-130.84 |
7.07 |
-8.32 |
-0.9 |
0 |
|
|
300945 |
123055443 |
1 |
NCl2O5H25C28 |
AB2C5D25E28 |
-130.24 |
5.41 |
-8.62 |
-0.74 |
0 |
|
|
300946 |
123055444 |
1 |
NCl2O5H21C26 |
AB2C5D21E26 |
-118.74 |
7.47 |
-8.5 |
-1.12 |
0 |
|
|
300947 |
123055446 |
1 |
NCl3O4H20C26 |
AB3C4D20E26 |
-96.63 |
9.76 |
-9.1 |
-0.89 |
0 |
|
|
300948 |
123055447 |
1 |
NCl3O5H18C25 |
AB3C5D18E25 |
-131.63 |
8.08 |
-8.82 |
-1.13 |
0 |
|
|
300949 |
123055450 |
1 |
NCl2O4H23C27 |
AB2C4D23E27 |
-96.11 |
4.61 |
-8.98 |
-0.84 |
0 |
|
|
300950 |
123055459 |
1 |
FN3O4C30H30 |
AB3C4D30E30 |
-108.03 |
5.24 |
-7.83 |
-0.74 |
0 |
|
|
300951 |
123058729 |
1 |
NO5H29C30 |
AB5C29D30 |
-136.34 |
5.19 |
-9.11 |
-1.26 |
0 |
|
|
300952 |
123058731 |
1 |
NO5H27C29 |
AB5C27D29 |
-125.6 |
7.62 |
-8.99 |
-1.2 |
0 |
|
|
300953 |
123058732 |
1 |
NO5H29C30 |
AB5C29D30 |
-132.8 |
7.18 |
-9.54 |
-1.07 |
0 |
|
|
300954 |
123058737 |
1 |
NF3O3H22C27 |
AB3C3D22E27 |
-196.53 |
5.14 |
-9.2 |
-1.07 |
0 |
|
|
300955 |
123058738 |
1 |
ClNO3H24C27 |
ABC3D24E27 |
-52.3 |
7.06 |
-9.09 |
-1.13 |
0 |
|
|
300956 |
123058739 |
1 |
NO5H29C30 |
AB5C29D30 |
-133.22 |
6.11 |
-9.13 |
-1.31 |
0 |
|
|
300957 |
123058741 |
1 |
SN2O5H24C26 |
AB2C5D24E26 |
-111.09 |
9.93 |
-9.43 |
-1.37 |
0 |
|
|
300958 |
123058742 |
2 |
NO2H13C14 |
AB2C13D14 |
-87.66 |
7.47 |
-8.75 |
-1.06 |
0 |
|
|
300959 |
123058745 |
1 |
NO4C29H29 |
AB4C29D29 |
-84.55 |
5.83 |
-8.88 |
-1.03 |
0 |
|
|
300960 |
123058746 |
1 |
N2O3H28C32 |
A2B3C28D32 |
-9.55 |
7.44 |
-8.28 |
-1.11 |
0 |
|
|
300961 |
123058748 |
1 |
NO6C32H35 |
AB6C32D35 |
-174.39 |
5.54 |
-8.85 |
-1.29 |
0 |
|
|
300962 |
123058751 |
1 |
ClNO5C30H30 |
ABC5D30E30 |
-137.52 |
9.46 |
-9.06 |
-1.06 |
0 |
|
|
300963 |
123058752 |
1 |
ClNO6H28C29 |
ABC6D28E29 |
-172.5 |
9.11 |
-8.8 |
-1.27 |
0 |
|
|
300964 |
123058754 |
1 |
NO5C31H33 |
AB5C31D33 |
-137.14 |
9.86 |
-8.88 |
-0.94 |
0 |
|
|
300965 |
123058756 |
1 |
NF3O5H28C30 |
AB3C5D28E30 |
-283.84 |
10.27 |
-9.17 |
-1.3 |
0 |
|
|
300966 |
123058758 |
1 |
NF2O5H27C29 |
AB2C5D27E29 |
-210.91 |
9.93 |
-9.08 |
-1.15 |
0 |
|
|
300967 |
123058762 |
1 |
NO7C29H29 |
AB7C29D29 |
-192.54 |
9.8 |
-8.47 |
-1.2 |
0 |
|
|
300968 |
123058763 |
1 |
NO7C30H31 |
AB7C30D31 |
-197.5 |
7.25 |
-8.48 |
-1.07 |
0 |
|
|
300969 |
123058765 |
2 |
NO3C16H18 |
AB3C16D18 |
-159.71 |
7.56 |
-7.79 |
-1.08 |
0 |
|
|
300970 |
123058766 |
2 |
NO3C15H16 |
AB3C15D16 |
-145.46 |
8.77 |
-8.21 |
-0.76 |
0 |
|
|
300971 |
123058769 |
1 |
NO8H29C30 |
AB8C29D30 |
-216.01 |
7.6 |
-8.34 |
-1.04 |
0 |
|
|
300972 |
123058772 |
1 |
NO7C32H35 |
AB7C32D35 |
-204.5 |
8.3 |
-8.27 |
-0.94 |
0 |
|
|
300973 |
123058780 |
1 |
NO6C30H31 |
AB6C30D31 |
-168.1 |
9.14 |
-8.37 |
-0.99 |
0 |
|
|
300974 |
123058781 |
1 |
NO6C32H35 |
AB6C32D35 |
-171.83 |
6.64 |
-8.42 |
-1.15 |
0 |
|
|
300975 |
123058782 |
1 |
NO6C30H31 |
AB6C30D31 |
-161.49 |
6.87 |
-8.42 |
-1.2 |
0 |
|
|
300976 |
123058784 |
1 |
NO8H29C30 |
AB8C29D30 |
-233.79 |
10.84 |
-8.62 |
-1.26 |
0 |
|
|
300977 |
123058785 |
1 |
NO8C31H31 |
AB8C31D31 |
-241.91 |
10.69 |
-8.6 |
-1.24 |
0 |
|
|
300978 |
123058793 |
1 |
NO6C30H31 |
AB6C30D31 |
-161.57 |
7.32 |
-8.47 |
-0.95 |
0 |
|
|
300979 |
123058810 |
1 |
N2O6H26C29 |
A2B6C26D29 |
-119.03 |
7.97 |
-8.63 |
-1.4 |
0 |
|
|
300980 |
123058814 |
1 |
N2O7C30H30 |
A2B7C30D30 |
-195.21 |
10.93 |
-8.63 |
-1.12 |
0 |
|
|
300981 |
123058816 |
1 |
NO7C32H35 |
AB7C32D35 |
-206.58 |
7.32 |
-8.28 |
-0.89 |
0 |
|
|
300982 |
123058830 |
1 |
NO6C32H35 |
AB6C32D35 |
-173.5 |
9.01 |
-8.31 |
-0.73 |
0 |