List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
337089 |
127256654 |
1 |
SO2C12H14 |
AB2C12D14 |
-68.63 |
6.77 |
-8.99 |
-0.59 |
0 |
|
|
337090 |
127256655 |
1 |
IO2C21H33 |
AB2C21D33 |
-89.59 |
3.23 |
-9.34 |
-1.26 |
0 |
|
|
337091 |
127256656 |
1 |
SO4H18C19 |
AB4C18D19 |
-101.89 |
7.45 |
-9.1 |
-0.95 |
0 |
|
|
337092 |
127256657 |
2 |
OC9H9 |
AB9C9 |
-52.73 |
5.11 |
-9.26 |
0.05 |
0 |
|
|
337093 |
127256658 |
1 |
SO4H16C17 |
AB4C16D17 |
-113.3 |
6.55 |
-9.61 |
-0.89 |
0 |
|
|
337094 |
127256659 |
1 |
O3C19H32 |
A3B19C32 |
-163.61 |
1.99 |
-8.7 |
0.25 |
0 |
|
|
337095 |
127256660 |
1 |
O3C19H32 |
A3B19C32 |
-163.78 |
1.84 |
-8.74 |
0.22 |
0 |
|
|
337096 |
127256661 |
1 |
ClO4C12H13 |
AB4C12D13 |
-152.39 |
3.43 |
-9.16 |
-0.8 |
0 |
|
|
337097 |
127256662 |
1 |
O5C8H8 |
A5B8C8 |
-177.17 |
4.15 |
-9.3 |
-0.98 |
0 |
|
|
337098 |
127256663 |
1 |
ClO4C7H9 |
AB4C7D9 |
-157.11 |
2.66 |
-8.84 |
-0.31 |
0 |
|
|
337099 |
127256664 |
1 |
O3C13H14 |
A3B13C14 |
-79.01 |
4.62 |
-8.38 |
-0.37 |
0 |
|
|
337100 |
127256665 |
1 |
O3C8H10 |
A3B8C10 |
-104.17 |
2.39 |
-8.52 |
0.01 |
0 |
|
|
337101 |
127256666 |
1 |
NO6C13H15 |
AB6C13D15 |
-139.03 |
3.35 |
-8.76 |
-0.5 |
0 |
|
|
337102 |
127256667 |
1 |
O4C13H16 |
A4B13C16 |
-132.2 |
2.59 |
-8.47 |
0.0 |
0 |
|
|
337103 |
127256668 |
1 |
O2C11H14 |
A2B11C14 |
-75.56 |
2.38 |
-9.5 |
0.21 |
0 |
|
|
337104 |
127256669 |
1 |
O4C13H16 |
A4B13C16 |
-130.03 |
3.21 |
-8.52 |
-0.03 |
0 |
|
|
337105 |
127256670 |
1 |
NSO4C6H11 |
ABC4D6E11 |
-157.46 |
4.0 |
-8.42 |
0.09 |
0 |
|
|
337106 |
127256671 |
1 |
ClO4H7C8 |
AB4C7D8 |
-137.79 |
3.76 |
-9.25 |
-0.99 |
0 |
|
|
337107 |
127256672 |
1 |
O3C12H14 |
A3B12C14 |
-94.33 |
1.75 |
-8.91 |
-0.48 |
0 |
|
|
337108 |
127256673 |
2 |
O2C4H5 |
A2B4C5 |
-144.12 |
2.24 |
-9.12 |
-0.74 |
0 |
|
|
337109 |
127256674 |
1 |
O3C15H16 |
A3B15C16 |
-66.06 |
2.29 |
-8.76 |
-0.02 |
0 |
|
|
337110 |
127256675 |
1 |
O4C7H10 |
A4B7C10 |
-160.29 |
6.6 |
-9.12 |
-0.3 |
0 |
|
|
337111 |
127256676 |
2 |
O2C3H4 |
A2B3C4 |
-144.17 |
5.55 |
-9.33 |
-0.51 |
0 |
|
|
337112 |
127256677 |
1 |
SO5C7H10 |
AB5C7D10 |
-193.51 |
3.37 |
-9.34 |
-0.19 |
0 |
|
|
337113 |
127256678 |
1 |
N4C17H22 |
A4B17C22 |
47.37 |
1.5 |
-8.73 |
-0.71 |
0 |
|
|
337114 |
127256679 |
1 |
SO2N3H5C7 |
AB2C3D5E7 |
97.04 |
5.73 |
-8.56 |
-1.32 |
0 |
|
|
337115 |
127256680 |
1 |
ON2H6C9 |
AB2C6D9 |
86.97 |
2.48 |
-10.48 |
-2.18 |
0 |
|
|
337116 |
127256681 |
1 |
NO2H5C6 |
AB2C5D6 |
-31.0 |
2.39 |
-10.1 |
-1.87 |
0 |
|
|
337117 |
127256682 |
1 |
NO2H5C6 |
AB2C5D6 |
-2.38 |
3.53 |
-10.4 |
-0.86 |
0 |
|
|
337118 |
127256683 |
1 |
NOCl2C15H17 |
ABC2D15E17 |
-44.09 |
1.33 |
-9.16 |
-0.6 |
0 |
|
|
337119 |
127256684 |
1 |
NO2C16H21 |
AB2C16D21 |
-68.77 |
4.5 |
-8.64 |
0.02 |
0 |
|
|
337120 |
127256685 |
1 |
NOC15H19 |
ABC15D19 |
-27.96 |
3.65 |
-8.91 |
0.13 |
0 |
|
|
337121 |
127256686 |
1 |
NOC15H19 |
ABC15D19 |
-24.67 |
3.76 |
-8.84 |
0.38 |
0 |
|
|
337122 |
127256687 |
1 |
NC11H21 |
AB11C21 |
-30.94 |
1.36 |
-8.4 |
2.97 |
0 |
|
|
337123 |
127256688 |
1 |
NC11H21 |
AB11C21 |
-29.92 |
1.26 |
-8.41 |
2.99 |
0 |
|
|
337124 |
127256689 |
1 |
NC11H21 |
AB11C21 |
-31.68 |
1.31 |
-8.4 |
3.0 |
0 |
|
|
337125 |
127256690 |
1 |
NC10H19 |
AB10C19 |
-27.36 |
1.37 |
-8.4 |
3.01 |
0 |
|
|
337126 |
127256691 |
1 |
NO2C11H19 |
AB2C11D19 |
-107.16 |
1.08 |
-8.72 |
0.79 |
0 |
|
|
337127 |
127256692 |
1 |
NO2C11H11 |
AB2C11D11 |
-40.07 |
4.21 |
-8.04 |
-0.66 |
0 |
|
|
337128 |
127256693 |
1 |
N5C9H9 |
A5B9C9 |
139.18 |
2.32 |
-9.6 |
-1.38 |
0 |
|
|
337129 |
127256694 |
1 |
ClOS2F3N7H15C18 |
ABC2D3E7F15G18 |
-42.37 |
1.82 |
-9.07 |
-1.2 |
0 |
|
|
337130 |
127256695 |
1 |
O2N4C9H16 |
A2B4C9D16 |
-41.05 |
2.14 |
-10.84 |
-0.6 |
0 |
|
|
337131 |
127256696 |
2 |
ON2C6H7 |
AB2C6D7 |
3.48 |
1.49 |
-9.35 |
-0.65 |
0 |
|
|
337132 |
127256697 |
1 |
O3N4C13H16 |
A3B4C13D16 |
-31.09 |
0.47 |
-9.38 |
-0.66 |
0 |
|
|
337133 |
127256698 |
1 |
ClN2S2O3H11C14 |
AB2C2D3E11F14 |
34.05 |
5.13 |
-8.73 |
-1.29 |
0 |
|
|
337134 |
127256699 |
2 |
NOSH2C3 |
ABCD2E3 |
89.62 |
1.78 |
-8.39 |
-1.31 |
0 |
|
|
337135 |
127256700 |
1 |
SH4O4C5 |
AB4C4D5 |
80.59 |
3.08 |
-9.64 |
-1.22 |
0 |
|
|
337136 |
127256701 |
1 |
SO4C6H6 |
AB4C6D6 |
-51.19 |
4.91 |
-9.71 |
-0.85 |
0 |
|
|
337137 |
127256702 |
1 |
SN2O2C5H8 |
AB2C2D5E8 |
-7.73 |
1.86 |
-8.97 |
0.01 |
0 |
|
|
337138 |
127256703 |
1 |
SO3C6H6 |
AB3C6D6 |
-3.56 |
4.52 |
-9.21 |
-0.74 |
0 |