List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
337039 |
127256604 |
1 |
O2S2C13H24 |
A2B2C13D24 |
-103.15 |
2.46 |
-8.34 |
0.28 |
0 |
|
|
337040 |
127256605 |
1 |
ClO2C14H17 |
AB2C14D17 |
-71.79 |
3.33 |
-8.9 |
-0.19 |
0 |
|
|
337041 |
127256606 |
1 |
O3C12H20 |
A3B12C20 |
-133.23 |
3.28 |
-9.64 |
1.13 |
0 |
|
|
337042 |
127256607 |
1 |
ClOC9H17 |
ABC9D17 |
-88.51 |
1.48 |
-9.99 |
0.77 |
0 |
|
|
337043 |
127256608 |
1 |
ClOC9H17 |
ABC9D17 |
-89.77 |
1.84 |
-9.82 |
0.75 |
0 |
|
|
337044 |
127256609 |
1 |
ClOC11H19 |
ABC11D19 |
-86.36 |
1.18 |
-9.97 |
0.86 |
0 |
|
|
337045 |
127256610 |
1 |
ClOC11H19 |
ABC11D19 |
-90.93 |
2.02 |
-9.76 |
0.82 |
0 |
|
|
337046 |
127256611 |
1 |
ClOC11H21 |
ABC11D21 |
-98.21 |
1.46 |
-9.98 |
0.78 |
0 |
|
|
337047 |
127256612 |
1 |
ClOC11H21 |
ABC11D21 |
-99.94 |
2.02 |
-9.81 |
0.78 |
0 |
|
|
337048 |
127256613 |
2 |
OC8H15 |
AB8C15 |
-132.13 |
0.6 |
-9.53 |
1.4 |
0 |
|
|
337049 |
127256614 |
2 |
OC11H21 |
AB11C21 |
-159.2 |
2.46 |
-9.29 |
1.49 |
0 |
|
|
337050 |
127256615 |
1 |
O3C20H38 |
A3B20C38 |
-185.12 |
1.53 |
-9.44 |
1.4 |
0 |
|
|
337051 |
127256616 |
1 |
O3C16H20 |
A3B16C20 |
-78.68 |
1.39 |
-8.85 |
0.28 |
0 |
|
|
337052 |
127256617 |
1 |
O3C14H24 |
A3B14C24 |
-147.95 |
0.83 |
-8.68 |
1.41 |
0 |
|
|
337053 |
127256618 |
1 |
OC9H16 |
AB9C16 |
-58.14 |
2.14 |
-9.6 |
1.16 |
0 |
|
|
337054 |
127256619 |
1 |
O5H8C9 |
A5B8C9 |
-157.17 |
3.21 |
-9.18 |
-0.64 |
0 |
|
|
337055 |
127256620 |
1 |
NO3C17H27 |
AB3C17D27 |
-159.08 |
3.92 |
-9.59 |
-0.59 |
0 |
|
|
337056 |
127256621 |
1 |
NO4C11H15 |
AB4C11D15 |
-159.87 |
4.42 |
-9.52 |
-0.52 |
0 |
|
|
337057 |
127256622 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-103.85 |
4.89 |
-7.97 |
0.19 |
0 |
|
|
337058 |
127256623 |
3 |
OC3H4 |
AB3C4 |
-114.42 |
2.14 |
-8.92 |
0.09 |
0 |
|
|
337059 |
127256624 |
3 |
OC7H12 |
AB7C12 |
-172.34 |
2.07 |
-8.88 |
0.13 |
0 |
|
|
337060 |
127256625 |
1 |
O3C19H32 |
A3B19C32 |
-162.73 |
1.92 |
-8.91 |
0.08 |
0 |
|
|
337061 |
127256626 |
1 |
O3C19H32 |
A3B19C32 |
-164.04 |
1.79 |
-8.71 |
0.25 |
0 |
|
|
337062 |
127256627 |
1 |
O3C13H14 |
A3B13C14 |
-71.54 |
1.11 |
-8.89 |
-0.02 |
0 |
|
|
337063 |
127256628 |
2 |
O2C5H6 |
A2B5C6 |
-130.82 |
4.7 |
-9.13 |
-0.22 |
0 |
|
|
337064 |
127256629 |
2 |
O2C5H6 |
A2B5C6 |
-129.66 |
3.88 |
-9.14 |
-0.2 |
0 |
|
|
337065 |
127256630 |
2 |
O2C7H7 |
A2B7C7 |
-110.73 |
4.04 |
-9.19 |
-0.65 |
0 |
|
|
337066 |
127256631 |
1 |
O3C19H32 |
A3B19C32 |
-153.9 |
2.61 |
-9.01 |
-0.12 |
0 |
|
|
337067 |
127256632 |
1 |
O3C19H32 |
A3B19C32 |
-164.8 |
1.28 |
-8.66 |
0.28 |
0 |
|
|
337068 |
127256633 |
1 |
O3C13H14 |
A3B13C14 |
-77.1 |
3.24 |
-8.73 |
-0.58 |
0 |
|
|
337069 |
127256634 |
4 |
OC2H3 |
AB2C3 |
-159.15 |
5.23 |
-9.21 |
-0.33 |
0 |
|
|
337070 |
127256635 |
1 |
O3C13H16 |
A3B13C16 |
-99.06 |
2.55 |
-8.78 |
0.18 |
0 |
|
|
337071 |
127256636 |
1 |
ClO3C8H13 |
AB3C8D13 |
-165.63 |
3.9 |
-10.46 |
0.48 |
0 |
|
|
337072 |
127256637 |
1 |
ClO3C8H13 |
AB3C8D13 |
-164.73 |
4.46 |
-10.5 |
0.39 |
0 |
|
|
337073 |
127256638 |
1 |
O4C7H10 |
A4B7C10 |
-163.87 |
5.95 |
-9.65 |
-0.47 |
0 |
|
|
337074 |
127256639 |
2 |
OC10H15 |
AB10C15 |
-116.83 |
3.35 |
-9.49 |
0.32 |
0 |
|
|
337075 |
127256640 |
1 |
O2C17H32 |
A2B17C32 |
-162.19 |
3.07 |
-10.06 |
2.07 |
0 |
|
|
337076 |
127256641 |
2 |
O2C5H7 |
A2B5C7 |
-163.48 |
3.31 |
-9.06 |
-0.37 |
0 |
|
|
337077 |
127256642 |
2 |
O2C4H5 |
A2B4C5 |
-151.45 |
3.32 |
-9.08 |
-0.39 |
0 |
|
|
337078 |
127256643 |
1 |
O3C8H14 |
A3B8C14 |
-157.11 |
2.73 |
-9.91 |
0.79 |
0 |
|
|
337079 |
127256644 |
1 |
NO2C8H13 |
AB2C8D13 |
-77.23 |
5.43 |
-8.51 |
0.26 |
0 |
|
|
337080 |
127256645 |
1 |
NO4C12H17 |
AB4C12D17 |
-130.42 |
3.56 |
-9.58 |
-0.72 |
0 |
|
|
337081 |
127256646 |
1 |
SO2C15H20 |
AB2C15D20 |
-82.19 |
4.38 |
-8.67 |
-0.23 |
0 |
|
|
337082 |
127256647 |
1 |
SO2C15H20 |
AB2C15D20 |
-85.65 |
4.76 |
-8.98 |
-0.45 |
0 |
|
|
337083 |
127256648 |
1 |
SO2C13H14 |
AB2C13D14 |
-47.59 |
4.38 |
-8.98 |
-0.46 |
0 |
|
|
337084 |
127256649 |
1 |
SO2C13H14 |
AB2C13D14 |
-45.17 |
6.56 |
-9.03 |
-0.63 |
0 |
|
|
337085 |
127256650 |
1 |
O3C16H16 |
A3B16C16 |
-76.21 |
3.59 |
-9.41 |
-0.77 |
0 |
|
|
337086 |
127256651 |
1 |
O5H14C16 |
A5B14C16 |
-152.65 |
5.66 |
-9.11 |
-1.14 |
0 |
|
|
337087 |
127256652 |
1 |
NO4C13H17 |
AB4C13D17 |
-107.84 |
3.01 |
-9.79 |
-0.76 |
0 |
|
|
337088 |
127256653 |
1 |
SO2C12H14 |
AB2C12D14 |
-69.09 |
3.8 |
-8.94 |
-0.4 |
0 |
|
|
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 |