List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
436044 |
135193525 |
1 |
ClO4C14H17 |
AB4C14D17 |
-178.31 |
1.54 |
-9.51 |
-0.32 |
0 |
|
|
436045 |
135193531 |
1 |
NO5C25H27 |
AB5C25D27 |
-189.17 |
3.25 |
-8.61 |
-0.72 |
0 |
|
|
436046 |
135193533 |
1 |
BrS2O4C12H17 |
AB2C4D12E17 |
-144.79 |
4.21 |
-8.78 |
-0.97 |
0 |
|
|
436047 |
135193550 |
1 |
ClN2O5H7C12 |
AB2C5D7E12 |
-73.76 |
9.22 |
-9.84 |
-2.11 |
0 |
|
|
436048 |
135193556 |
1 |
NSO2C20H23 |
ABC2D20E23 |
-56.51 |
2.26 |
-8.45 |
-1.03 |
0 |
|
|
436049 |
135193562 |
1 |
O2N6C11H24 |
A2B6C11D24 |
-35.39 |
6.03 |
-9.55 |
-0.16 |
0 |
|
|
436050 |
135193565 |
1 |
O2N3H23C24 |
A2B3C23D24 |
12.72 |
1.02 |
-8.17 |
-1.08 |
0 |
|
|
436051 |
135193572 |
1 |
SN2O3C22H44 |
AB2C3D22E44 |
-214.83 |
2.68 |
-8.56 |
0.71 |
0 |
|
|
436052 |
135193575 |
1 |
N5O7C45H45 |
A5B7C45D45 |
-108.89 |
3.73 |
-7.95 |
-0.87 |
0 |
|
|
436053 |
135193579 |
2 |
FON2C15H19 |
ABC2D15E19 |
-142.48 |
6.22 |
-8.48 |
-0.03 |
0 |
|
|
436054 |
135193583 |
2 |
FN2O2C17H21 |
AB2C2D17E21 |
-230.3 |
8.25 |
-9.06 |
-0.5 |
0 |
|
|
436055 |
135193587 |
1 |
F2N4O5C33H38 |
A2B4C5D33E38 |
-267.96 |
2.97 |
-8.87 |
-0.44 |
0 |
|
|
436056 |
135193594 |
1 |
F2N7O14C48H67 |
A2B7C14D48E67 |
-665.58 |
9.01 |
-8.79 |
-0.47 |
0 |
|
|
436057 |
135193628 |
1 |
SN3O3F5H20C27 |
AB3C3D5E20F27 |
-270.13 |
7.65 |
-9.36 |
-1.1 |
0 |
|
|
436058 |
135193635 |
1 |
N2P2O15C20H38 |
A2B2C15D20E38 |
-814.93 |
4.61 |
-10.08 |
0.1 |
0 |
|
|
436059 |
135193636 |
1 |
FON4C22H29 |
ABC4D22E29 |
-76.46 |
2.21 |
-8.3 |
0.13 |
0 |
|
|
436060 |
135193647 |
1 |
S3N5O10C31H51 |
A3B5C10D31E51 |
-397.09 |
3.21 |
-8.74 |
-1.43 |
0 |
|
|
436061 |
135193649 |
1 |
IN5O8C46H46 |
AB5C8D46E46 |
-11.54 |
11.76 |
-8.31 |
-1.08 |
0 |
|
|
436062 |
135193650 |
1 |
O2F3N4C27H29 |
A2B3C4D27E29 |
-176.71 |
7.68 |
-8.56 |
-0.31 |
0 |
|
|
436063 |
135193654 |
1 |
ClOSN8C27H37 |
ABCD8E27F37 |
61.63 |
12.92 |
-8.36 |
-0.75 |
0 |
|
|
436064 |
135193655 |
1 |
SO2N7C24H33 |
AB2C7D24E33 |
11.66 |
9.15 |
-7.88 |
-0.67 |
0 |
|
|
436065 |
135193661 |
1 |
OSN7C29H37 |
ABC7D29E37 |
55.72 |
4.28 |
-8.32 |
-0.71 |
0 |
|
|
436066 |
135193665 |
1 |
OSN6C13H22 |
ABC6D13E22 |
5.49 |
6.53 |
-8.42 |
-0.63 |
0 |
|
|
436067 |
135193666 |
1 |
OSN7C28H39 |
ABC7D28E39 |
32.08 |
6.43 |
-7.58 |
-0.49 |
0 |
|
|
436068 |
135193667 |
1 |
ClO2F3N6H26C27 |
AB2C3D6E26F27 |
-140.27 |
3.14 |
-8.6 |
-1.48 |
0 |
|
|
436069 |
135193680 |
1 |
ClO2F3N5C29H29 |
AB2C3D5E29F29 |
-168.75 |
4.68 |
-8.46 |
-0.77 |
0 |
|
|
436070 |
135193681 |
1 |
OSN6C28H40 |
ABC6D28E40 |
23.35 |
9.94 |
-8.12 |
-0.59 |
0 |
|
|
436071 |
135193682 |
1 |
INSC5H8 |
ABCD5E8 |
40.98 |
3.88 |
-8.77 |
-2.44 |
0 |
|
|
436072 |
135193689 |
1 |
N2O5C16H30 |
A2B5C16D30 |
-280.49 |
2.4 |
-9.7 |
0.33 |
0 |
|
|
436073 |
135193690 |
1 |
N2O5C15H28 |
A2B5C15D28 |
-278.06 |
2.35 |
-9.96 |
0.23 |
0 |
|
|
436074 |
135193691 |
1 |
PO2C31H49 |
AB2C31D49 |
-143.63 |
2.58 |
-7.86 |
0.26 |
0 |
|
|
436075 |
135193695 |
1 |
N7O12C55H85 |
A7B12C55D85 |
-540.11 |
5.98 |
-9.17 |
0.05 |
0 |
|
|
436076 |
135193697 |
1 |
ON4C27H28 |
AB4C27D28 |
51.52 |
5.66 |
-8.24 |
-0.89 |
0 |
|
|
436077 |
135193709 |
1 |
ClO2F3N5C22H23 |
AB2C3D5E22F23 |
-182.29 |
4.09 |
-8.7 |
-1.42 |
0 |
|
|
436078 |
135193713 |
1 |
FO2H9C17 |
AB2C9D17 |
-52.44 |
2.6 |
-9.22 |
-1.28 |
0 |
|
|
436079 |
135193714 |
1 |
F2O2H8C17 |
A2B2C8D17 |
-91.0 |
2.29 |
-9.28 |
-1.39 |
0 |
|
|
436080 |
135193719 |
1 |
ClO2H9C17 |
AB2C9D17 |
-10.48 |
1.46 |
-9.11 |
-1.26 |
0 |
|
|
436081 |
135193723 |
1 |
O2F3H9C18 |
A2B3C9D18 |
-166.32 |
5.66 |
-9.35 |
-1.44 |
0 |
|
|
436082 |
135193738 |
1 |
FO2H9C17 |
AB2C9D17 |
-51.5 |
3.74 |
-9.14 |
-1.34 |
0 |
|
|
436083 |
135193740 |
1 |
ClO2H9C17 |
AB2C9D17 |
-13.65 |
2.52 |
-9.2 |
-1.31 |
0 |
|
|
436084 |
135193748 |
1 |
F2O2H8C17 |
A2B2C8D17 |
-95.42 |
5.23 |
-9.35 |
-1.48 |
0 |
|
|
436085 |
135193752 |
2 |
O2H5C9 |
A2B5C9 |
-60.86 |
2.57 |
-8.4 |
-1.21 |
0 |
|
|
436086 |
135193759 |
1 |
F2O2H8C17 |
A2B2C8D17 |
-100.46 |
3.76 |
-9.49 |
-1.43 |
0 |
|
|
436087 |
135193760 |
1 |
F2O2H8C17 |
A2B2C8D17 |
-94.61 |
2.97 |
-9.37 |
-1.4 |
0 |
|
|
436088 |
135193764 |
1 |
O6H10C19 |
A6B10C19 |
-120.87 |
1.76 |
-8.4 |
-1.24 |
0 |
|
|
436089 |
135193769 |
1 |
F3O3H11C19 |
A3B3C11D19 |
-201.47 |
4.19 |
-9.37 |
-1.4 |
0 |
|
|
436090 |
135193775 |
1 |
O3H14C19 |
A3B14C19 |
-57.34 |
1.55 |
-8.79 |
-0.99 |
0 |
|
|
436091 |
135193788 |
1 |
FO3H11C18 |
AB3C11D18 |
-91.28 |
3.65 |
-9.09 |
-1.12 |
0 |
|
|
436092 |
135193789 |
1 |
F3O3H11C19 |
A3B3C11D19 |
-196.97 |
3.57 |
-9.12 |
-1.32 |
0 |
|
|
436093 |
135193792 |
1 |
FO3H11C18 |
AB3C11D18 |
-90.68 |
2.93 |
-8.89 |
-1.28 |
0 |