List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
145764 |
53589549 |
2 |
N3C8H9 |
A3B8C9 |
109.2 |
3.84 |
-8.66 |
-0.77 |
0 |
|
|
145765 |
53590218 |
1 |
BrN2S2O5C16H17 |
AB2C2D5E16F17 |
-151.99 |
9.13 |
-8.71 |
-1.5 |
0 |
|
|
145766 |
53590378 |
1 |
NO4C19H29 |
AB4C19D29 |
-171.64 |
4.73 |
-8.63 |
0.26 |
0 |
|
|
145767 |
53590682 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-217.53 |
4.41 |
-8.8 |
-0.01 |
0 |
|
|
145768 |
53590683 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-95.74 |
2.76 |
-9.36 |
-0.16 |
0 |
|
|
145769 |
53590749 |
1 |
ClSN2O2C16H23 |
ABC2D2E16F23 |
-82.31 |
6.46 |
-9.17 |
-0.17 |
0 |
|
|
145770 |
53590750 |
3 |
NC4H7 |
AB4C7 |
28.29 |
1.66 |
-9.05 |
0.88 |
0 |
|
|
145771 |
53590751 |
1 |
SO3N4C13H24 |
AB3C4D13E24 |
-70.05 |
5.99 |
-8.8 |
-0.19 |
0 |
|
|
145772 |
53590855 |
1 |
FON3C18H22 |
ABC3D18E22 |
-37.13 |
6.87 |
-9.06 |
-0.31 |
0 |
|
|
145773 |
53591055 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-83.54 |
5.09 |
-9.27 |
0.12 |
0 |
|
|
145774 |
53591155 |
1 |
FN5C16H20 |
AB5C16D20 |
13.97 |
5.19 |
-8.88 |
-0.12 |
0 |
|
|
145775 |
53591156 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-104.41 |
4.43 |
-8.55 |
-0.21 |
0 |
|
|
145776 |
53591505 |
1 |
ON5C20H23 |
AB5C20D23 |
27.75 |
5.66 |
-8.61 |
-0.35 |
0 |
|
|
145777 |
53591506 |
1 |
ON4C17H20 |
AB4C17D20 |
19.21 |
6.17 |
-8.65 |
-0.22 |
0 |
|
|
145778 |
53591735 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-43.37 |
5.51 |
-8.96 |
-0.34 |
0 |
|
|
145779 |
53591835 |
1 |
SN6C15H18 |
AB6C15D18 |
118.91 |
5.15 |
-9.09 |
-1.39 |
0 |
|
|
145780 |
53592047 |
1 |
O3N4C15H22 |
A3B4C15D22 |
-97.77 |
2.88 |
-8.97 |
-0.05 |
0 |
|
|
145781 |
53592389 |
1 |
ClFO2N3C16H21 |
ABC2D3E16F21 |
-146.47 |
5.3 |
-9.65 |
-0.48 |
0 |
|
|
145782 |
53592390 |
1 |
OF2N3C17H17 |
AB2C3D17E17 |
-94.81 |
7.63 |
-8.72 |
-0.51 |
0 |
|
|
145783 |
53592391 |
2 |
NOSH6C8 |
ABCD6E8 |
5.56 |
3.0 |
-9.21 |
-1.41 |
0 |
|
|
145784 |
53592392 |
1 |
FO2N5C17H22 |
AB2C5D17E22 |
-88.19 |
3.85 |
-8.98 |
-0.4 |
0 |
|
|
145785 |
53592681 |
2 |
ON2C8H17 |
AB2C8D17 |
-133.01 |
3.56 |
-8.91 |
0.94 |
0 |
|
|
145786 |
53592749 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-58.98 |
4.29 |
-8.96 |
-0.35 |
0 |
|
|
145787 |
53592977 |
1 |
ON3F4H15C16 |
AB3C4D15E16 |
-195.25 |
6.88 |
-9.48 |
-1.35 |
0 |
|
|
145788 |
53592978 |
1 |
ON5C19H21 |
AB5C19D21 |
44.58 |
5.87 |
-8.73 |
-0.3 |
0 |
|
|
145789 |
53593061 |
2 |
ON2C7H13 |
AB2C7D13 |
-107.98 |
3.93 |
-8.67 |
0.3 |
0 |
|
|
145790 |
53593140 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-39.58 |
9.0 |
-8.61 |
0.16 |
0 |
|
|
145791 |
53593141 |
1 |
N2S3O4C10H10 |
A2B3C4D10E10 |
-103.83 |
6.61 |
-8.86 |
-1.56 |
0 |
|
|
145792 |
53593491 |
1 |
ON3C18H25 |
AB3C18D25 |
-0.42 |
2.15 |
-8.94 |
0.06 |
0 |
|
|
145793 |
53593527 |
1 |
NSO6C15H23 |
ABC6D15E23 |
-243.26 |
6.23 |
-8.86 |
-0.49 |
0 |
|
|
145794 |
53593721 |
1 |
FSN2O3C17H17 |
ABC2D3E17F17 |
-101.64 |
10.8 |
-9.36 |
-0.78 |
0 |
|
|
145795 |
53593735 |
1 |
SN3O3C16H25 |
AB3C3D16E25 |
-127.76 |
8.23 |
-9.19 |
-0.48 |
0 |
|
|
145796 |
53593983 |
1 |
FN2O3C16H21 |
AB2C3D16E21 |
-161.51 |
5.21 |
-9.18 |
-0.56 |
0 |
|
|
145797 |
53594016 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-120.36 |
3.28 |
-8.93 |
0.15 |
0 |
|
|
145798 |
53594799 |
1 |
N3O3C17H27 |
A3B3C17D27 |
-132.39 |
4.32 |
-8.52 |
-0.76 |
0 |
|
|
145799 |
53594881 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-53.07 |
2.33 |
-8.86 |
-0.92 |
0 |
|
|
145800 |
53594882 |
1 |
O2N5H13C15 |
A2B5C13D15 |
96.59 |
8.59 |
-8.6 |
-1.08 |
0 |
|
|
145801 |
53595210 |
1 |
SN6C16H18 |
AB6C16D18 |
110.78 |
4.23 |
-8.64 |
-0.74 |
0 |
|
|
145802 |
53595375 |
1 |
N3O4C17H23 |
A3B4C17D23 |
-37.07 |
9.84 |
-9.16 |
-1.05 |
0 |
|
|
145803 |
53595800 |
1 |
ON4C17H20 |
AB4C17D20 |
25.18 |
5.22 |
-9.28 |
-0.4 |
0 |
|
|
145804 |
53596807 |
1 |
ON4C20H30 |
AB4C20D30 |
-26.56 |
4.3 |
-8.05 |
0.12 |
0 |
|
|
145805 |
53596808 |
1 |
SN3O3C16H21 |
AB3C3D16E21 |
-50.28 |
4.15 |
-9.04 |
-0.49 |
0 |
|
|
145806 |
53596888 |
1 |
N3O4C18H25 |
A3B4C18D25 |
-179.45 |
4.47 |
-9.14 |
-0.56 |
0 |
|
|
145807 |
53597429 |
1 |
ClSO2N3C15H18 |
ABC2D3E15F18 |
-29.93 |
6.84 |
-9.35 |
-0.11 |
0 |
|
|
145808 |
53597430 |
1 |
O2F3N5C14H16 |
A2B3C5D14E16 |
-155.39 |
0.98 |
-8.72 |
-0.23 |
0 |
|
|
145809 |
53597431 |
1 |
OSN4C17H18 |
ABC4D17E18 |
28.18 |
4.2 |
-8.06 |
-1.18 |
0 |
|
|
145810 |
53597432 |
1 |
N3O4C18H19 |
A3B4C18D19 |
-68.78 |
4.22 |
-9.43 |
-1.24 |
0 |
|
|
145811 |
53598233 |
1 |
NSO4C17H25 |
ABC4D17E25 |
-161.97 |
4.33 |
-9.7 |
-0.64 |
0 |
|
|
145812 |
53598234 |
1 |
N2O6C15H18 |
A2B6C15D18 |
-145.3 |
7.64 |
-9.66 |
-1.56 |
0 |
|
|
145813 |
53598235 |
2 |
ON2C8H13 |
AB2C8D13 |
-47.48 |
7.44 |
-8.81 |
0.41 |
0 |