List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
419647 |
135108635 |
1 |
N2O2C19H26 |
A2B2C19D26 |
-49.17 |
2.59 |
-8.83 |
-0.23 |
0 |
|
|
419648 |
135108649 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
3.44 |
3.43 |
-9.6 |
-1.19 |
0 |
|
|
419649 |
135108664 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-54.62 |
6.63 |
-9.25 |
0.33 |
0 |
|
|
419650 |
135108665 |
1 |
N5O5C33H43 |
A5B5C33D43 |
-190.21 |
9.13 |
-9.17 |
-0.35 |
0 |
|
|
419651 |
135108666 |
1 |
SN3O5C18H27 |
AB3C5D18E27 |
-203.87 |
5.77 |
-9.24 |
-0.48 |
0 |
|
|
419652 |
135108667 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-99.53 |
2.16 |
-8.4 |
-0.04 |
0 |
|
|
419653 |
135108668 |
1 |
SN3O3C16H23 |
AB3C3D16E23 |
-106.62 |
6.0 |
-8.85 |
-0.5 |
0 |
|
|
419654 |
135108669 |
1 |
OSN4C20H20 |
ABC4D20E20 |
31.65 |
4.03 |
-9.43 |
-1.16 |
0 |
|
|
419655 |
135108670 |
1 |
ClN4O6H27C30 |
AB4C6D27E30 |
-148.93 |
5.21 |
-8.92 |
-0.77 |
0 |
|
|
419656 |
135108671 |
1 |
NO3C22H33 |
AB3C22D33 |
-118.16 |
2.12 |
-8.15 |
0.34 |
0 |
|
|
419657 |
135108672 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-63.82 |
6.16 |
-8.99 |
-0.77 |
0 |
|
|
419658 |
135108673 |
1 |
SN3O4C19H23 |
AB3C4D19E23 |
-116.78 |
4.25 |
-9.23 |
-0.8 |
0 |
|
|
419659 |
135108674 |
2 |
SN2C8H9 |
AB2C8D9 |
75.41 |
1.83 |
-8.3 |
-0.92 |
0 |
|
|
419660 |
135108675 |
1 |
O2N5C23H23 |
A2B5C23D23 |
40.95 |
3.39 |
-9.04 |
-0.79 |
0 |
|
|
419661 |
135108676 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-52.35 |
5.02 |
-8.46 |
-0.55 |
0 |
|
|
419662 |
135108677 |
1 |
SO2N3C20H29 |
AB2C3D20E29 |
-45.75 |
3.8 |
-8.98 |
-0.47 |
0 |
|
|
419663 |
135108678 |
1 |
SN3O5C19H23 |
AB3C5D19E23 |
-149.43 |
9.25 |
-9.82 |
-0.89 |
0 |
|
|
419664 |
135108679 |
1 |
ON4C18H22 |
AB4C18D22 |
69.12 |
5.44 |
-8.33 |
-0.27 |
0 |
|
|
419665 |
135108680 |
1 |
ClN3O4C22H26 |
AB3C4D22E26 |
-117.2 |
6.44 |
-9.36 |
-0.43 |
0 |
|
|
419666 |
135108681 |
1 |
ClN2O3C20H25 |
AB2C3D20E25 |
-129.15 |
6.79 |
-8.64 |
-0.66 |
0 |
|
|
419667 |
135108682 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-36.86 |
7.46 |
-8.75 |
0.19 |
0 |
|
|
419668 |
135108683 |
2 |
ON2C10H13 |
AB2C10D13 |
-50.14 |
5.28 |
-8.32 |
0.01 |
0 |
|
|
419669 |
135108684 |
1 |
ON5C19H23 |
AB5C19D23 |
41.94 |
6.31 |
-8.99 |
-0.25 |
0 |
|
|
419670 |
135108685 |
4 |
NOC5H6 |
ABC5D6 |
-93.77 |
4.32 |
-8.95 |
-0.42 |
0 |
|
|
419671 |
135108686 |
1 |
ON4C19H22 |
AB4C19D22 |
56.0 |
3.07 |
-9.01 |
-0.51 |
0 |
|
|
419673 |
135108688 |
1 |
FO2N4C19H19 |
AB2C4D19E19 |
-14.37 |
4.69 |
-9.03 |
-0.95 |
0 |
|
|
419674 |
135108689 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-39.85 |
5.33 |
-8.79 |
-0.68 |
0 |
|
|
419675 |
135108690 |
1 |
FO3N4C17H23 |
AB3C4D17E23 |
-89.5 |
4.12 |
-8.97 |
-0.98 |
0 |
|
|
419676 |
135108691 |
1 |
N3O3C24H29 |
A3B3C24D29 |
-95.93 |
9.06 |
-9.2 |
-0.32 |
0 |
|
|
419677 |
135108692 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-41.05 |
2.86 |
-8.82 |
0.66 |
0 |
|
|
419678 |
135108693 |
1 |
O2N4C15H24 |
A2B4C15D24 |
0.38 |
3.29 |
-8.86 |
0.94 |
0 |
|
|
419679 |
135108694 |
1 |
SN3O5C13H21 |
AB3C5D13E21 |
-187.83 |
5.04 |
-9.76 |
-0.72 |
0 |
|
|
419680 |
135108695 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-68.24 |
4.74 |
-9.62 |
-0.95 |
0 |
|
|
419681 |
135108696 |
1 |
NF3O3C17H22 |
AB3C3D17E22 |
-290.04 |
6.91 |
-9.47 |
0.25 |
0 |
|
|
419682 |
135108697 |
1 |
SN5O6C32H45 |
AB5C6D32E45 |
-265.06 |
8.55 |
-9.28 |
-0.9 |
0 |
|
|
419683 |
135108698 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-54.44 |
4.29 |
-8.57 |
-0.44 |
0 |
|
|
419684 |
135108699 |
1 |
N2O6C17H18 |
A2B6C17D18 |
-191.69 |
5.14 |
-8.89 |
-0.51 |
0 |
|
|
419685 |
135108700 |
1 |
NO4C20H25 |
AB4C20D25 |
-157.16 |
6.45 |
-9.07 |
-0.28 |
0 |
|
|
419686 |
135108701 |
2 |
O2N4C15H18 |
A2B4C15D18 |
-66.52 |
3.01 |
-9.03 |
-0.21 |
0 |
|
|
419687 |
135108702 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-46.31 |
2.37 |
-9.19 |
-0.76 |
0 |
|
|
419689 |
135108704 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-83.41 |
4.69 |
-8.94 |
-0.17 |
0 |
|
|
419690 |
135108705 |
1 |
O2N5C16H21 |
A2B5C16D21 |
30.08 |
2.12 |
-8.94 |
-1.19 |
0 |
|
|
419691 |
135108706 |
2 |
NOC10H13 |
ABC10D13 |
-69.36 |
3.57 |
-8.77 |
-0.75 |
0 |
|
|
419692 |
135108707 |
2 |
ON3C9H12 |
AB3C9D12 |
-11.07 |
8.78 |
-9.06 |
-0.68 |
0 |
|
|
419693 |
135108708 |
1 |
ClSN6O6C33H43 |
ABC6D6E33F43 |
-260.86 |
2.36 |
-9.06 |
-0.74 |
0 |
|
|
419694 |
135108709 |
2 |
NO2C12H18 |
AB2C12D18 |
-170.93 |
4.24 |
-8.39 |
0.06 |
0 |
|
|
419695 |
135108710 |
1 |
FN2O2C18H27 |
AB2C2D18E27 |
-117.37 |
4.21 |
-8.69 |
-0.21 |
0 |
|
|
419696 |
135108711 |
1 |
ON5C16H23 |
AB5C16D23 |
31.72 |
4.02 |
-8.7 |
-0.42 |
0 |
|
|
419697 |
135108712 |
1 |
O2N4H18C21 |
A2B4C18D21 |
32.97 |
6.76 |
-9.28 |
-1.72 |
0 |
|
|
419698 |
135108718 |
1 |
N6O7C30H42 |
A6B7C30D42 |
-276.55 |
5.16 |
-8.82 |
-0.32 |
0 |
|
|
419699 |
135108719 |
2 |
NOC11H15 |
ABC11D15 |
-46.86 |
1.78 |
-8.71 |
0.04 |
0 |
|
|
419700 |
135108720 |
1 |
SO2N5C14H19 |
AB2C5D14E19 |
-38.68 |
2.8 |
-8.97 |
-0.7 |
0 |
|
|
419701 |
135108721 |
2 |
ON2C8H11 |
AB2C8D11 |
-36.0 |
3.25 |
-9.07 |
-0.33 |
0 |
|
|
419702 |
135108722 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-74.59 |
5.06 |
-8.71 |
-0.83 |
0 |
|
|
419703 |
135108723 |
5 |
NC4H5 |
AB4C5 |
56.9 |
3.92 |
-7.94 |
0.02 |
0 |
|
|
419704 |
135108724 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-64.57 |
4.85 |
-9.8 |
-1.02 |
0 |
|
|
419705 |
135108725 |
1 |
SN3O4C13H19 |
AB3C4D13E19 |
-140.06 |
5.29 |
-9.36 |
-0.18 |
0 |
|
|
419706 |
135108726 |
1 |
N3O4C21H25 |
A3B4C21D25 |
-129.26 |
6.92 |
-9.26 |
-0.7 |
0 |
|
|
419707 |
135108727 |
2 |
NOC10H15 |
ABC10D15 |
-89.76 |
3.75 |
-9.11 |
0.36 |
0 |
|
|
419708 |
135108748 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-70.83 |
2.12 |
-8.82 |
0.19 |
0 |
|
|
419709 |
135108759 |
1 |
ON4C19H22 |
AB4C19D22 |
20.49 |
4.69 |
-9.07 |
-0.72 |
0 |
|
|
419711 |
135108797 |
1 |
ON3C23H27 |
AB3C23D27 |
-4.96 |
2.26 |
-9.28 |
-0.88 |
0 |
|
|
419712 |
135108806 |
1 |
ON3C26H43 |
AB3C26D43 |
-60.17 |
1.59 |
-8.13 |
0.7 |
0 |
|
|
419713 |
135108808 |
1 |
NO4C16H23 |
AB4C16D23 |
-172.85 |
5.55 |
-9.1 |
0.38 |
0 |
|
|
419714 |
135108813 |
1 |
ON5C18H21 |
AB5C18D21 |
10.34 |
3.47 |
-8.86 |
-0.44 |
0 |
|
|
419715 |
135108816 |
1 |
N5O6C34H49 |
A5B6C34D49 |
-196.78 |
9.32 |
-8.4 |
-0.16 |
0 |
|
|
419716 |
135108822 |
1 |
ON4C19H22 |
AB4C19D22 |
26.99 |
2.88 |
-8.97 |
-0.57 |
0 |
|
|
419717 |
135108841 |
1 |
ClN3O3C13H18 |
AB3C3D13E18 |
-118.01 |
4.55 |
-9.22 |
-0.82 |
0 |
|
|
419718 |
135108862 |
1 |
N3O4C20H23 |
A3B4C20D23 |
-93.17 |
5.65 |
-9.47 |
-1.08 |
0 |
|
|
419719 |
135108863 |
1 |
ClO2N6C15H17 |
AB2C6D15E17 |
27.6 |
4.71 |
-9.18 |
-0.74 |
0 |
|
|
419720 |
135108865 |
1 |
N3O4C16H19 |
A3B4C16D19 |
-113.83 |
4.67 |
-8.83 |
-0.25 |
0 |
|
|
419722 |
135108874 |
1 |
SO6N9C38H47 |
AB6C9D38E47 |
-166.65 |
12.78 |
-8.17 |
-1.17 |
0 |
|
|
419723 |
135108875 |
2 |
ON2C10H14 |
AB2C10D14 |
-23.91 |
6.61 |
-8.74 |
-0.11 |
0 |
|
|
419724 |
135108903 |
1 |
SN2O2C22H24 |
AB2C2D22E24 |
-41.77 |
5.69 |
-8.34 |
-0.3 |
0 |
|
|
419725 |
135108908 |
1 |
N4O5C20H26 |
A4B5C20D26 |
-142.55 |
2.68 |
-9.07 |
-0.46 |
0 |
|
|
419726 |
135108909 |
1 |
ClFN4O4C20H22 |
ABC4D4E20F22 |
-140.73 |
7.62 |
-9.45 |
-0.87 |
0 |
|
|
419727 |
135108910 |
2 |
N3O3C19H25 |
A3B3C19D25 |
-194.4 |
2.87 |
-9.72 |
-0.64 |
0 |
|
|
419728 |
135108911 |
2 |
ON2C9H11 |
AB2C9D11 |
-32.59 |
6.35 |
-9.54 |
-0.11 |
0 |
|
|
419729 |
135108912 |
1 |
ON6C14H16 |
AB6C14D16 |
72.4 |
6.02 |
-9.04 |
-0.68 |
0 |
|
|
419730 |
135108913 |
1 |
N4O5C36H48 |
A4B5C36D48 |
-183.63 |
6.09 |
-8.74 |
-0.06 |
0 |
|
|
419731 |
135108914 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-113.73 |
2.85 |
-8.88 |
-0.24 |
0 |
|
|
419732 |
135108915 |
1 |
NO3C12H21 |
AB3C12D21 |
-148.89 |
7.8 |
-9.44 |
0.98 |
0 |
|
|
419733 |
135108916 |
1 |
SN4O4C17H28 |
AB4C4D17E28 |
-156.3 |
5.52 |
-9.17 |
0.45 |
0 |
|
|
419735 |
135108918 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-127.03 |
2.95 |
-9.45 |
-0.78 |
0 |
|
|
419736 |
135108923 |
1 |
SO2N6C17H22 |
AB2C6D17E22 |
-2.61 |
3.56 |
-9.06 |
-1.03 |
0 |
|
|
419737 |
135108924 |
1 |
SO2N3C19H23 |
AB2C3D19E23 |
-28.87 |
6.8 |
-8.62 |
-0.33 |
0 |
|
|
419738 |
135108925 |
1 |
FN2O2C20H21 |
AB2C2D20E21 |
-61.62 |
5.42 |
-8.56 |
-0.14 |
0 |
|
|
419739 |
135108926 |
1 |
ClNSO2C19H20 |
ABCD2E19F20 |
-57.9 |
4.76 |
-9.3 |
-0.35 |
0 |
|
|
419740 |
135108927 |
1 |
N7O8C42H53 |
A7B8C42D53 |
-238.85 |
10.68 |
-9.34 |
-2.08 |
0 |
|
|
419741 |
135108928 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-51.05 |
6.23 |
-9.19 |
-0.56 |
0 |
|
|
419742 |
135108929 |
1 |
ClN5C13H18 |
AB5C13D18 |
35.7 |
3.36 |
-8.94 |
-0.29 |
0 |
|
|
419743 |
135108930 |
1 |
ON3C24H29 |
AB3C24D29 |
-8.65 |
1.96 |
-9.18 |
-0.86 |
0 |
|
|
419744 |
135108931 |
1 |
ClOSN4C16H17 |
ABCD4E16F17 |
24.92 |
4.03 |
-9.14 |
-1.38 |
0 |
|
|
419745 |
135108932 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-88.91 |
4.81 |
-8.55 |
-0.23 |
0 |
|
|
419747 |
135108934 |
1 |
SN5O6C30H39 |
AB5C6D30E39 |
-218.3 |
8.98 |
-9.45 |
-1.35 |
0 |
|
|
419748 |
135108935 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-64.3 |
5.77 |
-9.31 |
-0.53 |
0 |
|
|
419749 |
135108936 |
1 |
SN2O5C15H22 |
AB2C5D15E22 |
-184.11 |
6.77 |
-8.86 |
-0.03 |
0 |
|
|
419750 |
135108937 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-57.36 |
6.14 |
-8.97 |
-0.32 |
0 |
|
|
419752 |
135108939 |
2 |
NO2C8H12 |
AB2C8D12 |
-122.67 |
3.21 |
-9.64 |
-0.15 |
0 |
|
|
419753 |
135108958 |
1 |
ClN3O3C20H20 |
AB3C3D20E20 |
-46.38 |
4.82 |
-9.34 |
-1.14 |
0 |