List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
242678 |
98457897 |
1 |
N3O6C29H39 |
A3B6C29D39 |
-205.94 |
1.5 |
-8.43 |
-0.02 |
0 |
|
|
242680 |
98457904 |
1 |
N3O5C32H37 |
A3B5C32D37 |
-143.75 |
5.37 |
-8.16 |
-0.12 |
0 |
|
|
242682 |
98457909 |
1 |
N3O5C31H41 |
A3B5C31D41 |
-187.02 |
5.38 |
-8.15 |
0.27 |
0 |
|
|
242683 |
98457911 |
1 |
N3O5C29H39 |
A3B5C29D39 |
-186.87 |
6.7 |
-8.25 |
0.03 |
0 |
|
|
242684 |
98457919 |
1 |
ClN3O4C28H36 |
AB3C4D28E36 |
-162.54 |
9.43 |
-8.82 |
-0.02 |
0 |
|
|
242685 |
98457935 |
1 |
ClN3O5C27H34 |
AB3C5D27E34 |
-167.46 |
4.64 |
-9.11 |
-0.27 |
0 |
|
|
242686 |
98457940 |
1 |
ClN3O5C28H36 |
AB3C5D28E36 |
-190.98 |
8.35 |
-8.9 |
-0.06 |
0 |
|
|
242687 |
98457941 |
1 |
ClN3O5C28H36 |
AB3C5D28E36 |
-176.83 |
2.47 |
-9.22 |
-0.37 |
0 |
|
|
242691 |
98457975 |
1 |
ClN3O4C29H38 |
AB3C4D29E38 |
-148.71 |
5.25 |
-8.93 |
-0.35 |
0 |
|
|
242693 |
98457984 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-59.01 |
6.06 |
-8.52 |
-0.82 |
0 |
|
|
242694 |
98457989 |
1 |
ClN3O5C27H34 |
AB3C5D27E34 |
-167.24 |
4.71 |
-8.9 |
-0.31 |
0 |
|
|
242697 |
98457997 |
1 |
ClN3O5C28H36 |
AB3C5D28E36 |
-176.51 |
3.17 |
-8.98 |
-0.4 |
0 |
|
|
242700 |
98458014 |
1 |
ClN3O4C29H38 |
AB3C4D29E38 |
-169.18 |
7.19 |
-8.7 |
-0.04 |
0 |
|
|
242701 |
98458016 |
1 |
ClN3O4C29H38 |
AB3C4D29E38 |
-154.71 |
3.44 |
-8.86 |
-0.21 |
0 |
|
|
242702 |
98458017 |
1 |
ClN3O4C29H38 |
AB3C4D29E38 |
-154.65 |
3.17 |
-8.87 |
-0.22 |
0 |
|
|
242703 |
98458018 |
1 |
ClN3O4C28H36 |
AB3C4D28E36 |
-161.8 |
7.12 |
-8.7 |
-0.04 |
0 |
|
|
242704 |
98461896 |
1 |
NO6H31C35 |
AB6C31D35 |
-101.66 |
8.79 |
-8.34 |
-0.64 |
0 |
|
|
242705 |
98461916 |
2 |
NO2C13H16 |
AB2C13D16 |
-144.44 |
3.48 |
-8.74 |
-0.53 |
0 |
|
|
242707 |
98461938 |
1 |
N3C7H7 |
A3B7C7 |
75.03 |
2.57 |
-8.7 |
-1.17 |
0 |
|
|
242709 |
98461946 |
1 |
PO2N3H33C38 |
AB2C3D33E38 |
71.91 |
11.45 |
0.0 |
0.0 |
0 |
|
|
242710 |
98461947 |
1 |
N2O5H18C19 |
A2B5C18D19 |
-179.3 |
9.04 |
-8.88 |
-1.14 |
0 |
|
|
242711 |
98461961 |
1 |
ClO3N5H22C31 |
AB3C5D22E31 |
107.27 |
4.09 |
-8.76 |
-1.34 |
0 |
|
|
242712 |
98461962 |
1 |
ClO3N5H22C31 |
AB3C5D22E31 |
106.19 |
4.42 |
-8.77 |
-1.32 |
0 |
|
|
242713 |
99008633 |
1 |
N4O5C19H20 |
A4B5C19D20 |
-90.47 |
6.56 |
-9.44 |
-1.54 |
0 |
|
|
242714 |
99008654 |
1 |
ClO2F3N3H19C21 |
AB2C3D3E19F21 |
-165.61 |
4.94 |
-8.99 |
-1.12 |
0 |
|
|
242715 |
99008666 |
1 |
F2N3O5C21H27 |
A2B3C5D21E27 |
-307.25 |
5.41 |
-9.62 |
-0.55 |
0 |
|
|
242716 |
99008672 |
2 |
NO2C10H15 |
AB2C10D15 |
-182.42 |
2.45 |
-8.86 |
0.24 |
0 |
|
|
242717 |
99205861 |
1 |
BrSN2O5C17H19 |
ABC2D5E17F19 |
-150.68 |
6.82 |
-9.03 |
-0.98 |
0 |
|
|
242718 |
99205863 |
1 |
BrClN2S2O3H12C13 |
ABC2D2E3F12G13 |
-65.75 |
5.46 |
-9.52 |
-1.57 |
0 |
|
|
242719 |
99205865 |
1 |
SCl2N3O5C16H17 |
AB2C3D5E16F17 |
-151.26 |
5.73 |
-9.8 |
-1.92 |
0 |
|
|
242720 |
99205868 |
1 |
BrNS2O4C16H18 |
ABC2D4E16F18 |
-125.19 |
6.84 |
-9.04 |
-1.26 |
0 |
|
|
242721 |
99205874 |
1 |
ClSO2N3C16H26 |
ABC2D3E16F26 |
-86.66 |
5.68 |
-9.03 |
0.03 |
0 |
|
|
242722 |
99205875 |
1 |
BrSN2O3C13H21 |
ABC2D3E13F21 |
-110.09 |
4.84 |
-8.86 |
-0.05 |
0 |
|
|
242723 |
99205877 |
1 |
SO3N4C16H24 |
AB3C4D16E24 |
-73.38 |
5.54 |
-8.86 |
-0.08 |
0 |
|
|
242724 |
99205879 |
1 |
O2S2N3C17H19 |
A2B2C3D17E19 |
-14.03 |
4.76 |
-9.14 |
-0.72 |
0 |
|
|
242725 |
99205882 |
1 |
BrSN2O3C15H19 |
ABC2D3E15F19 |
-71.56 |
3.41 |
-9.02 |
-0.87 |
0 |
|
|
242726 |
99205885 |
1 |
SO3N4C17H28 |
AB3C4D17E28 |
-116.01 |
5.65 |
-8.78 |
-0.11 |
0 |
|
|
242727 |
99205886 |
1 |
BrNS2O6C15H20 |
ABC2D6E15F20 |
-235.75 |
5.99 |
-9.47 |
-1.38 |
0 |
|
|
242728 |
99205887 |
1 |
BrNS2O4C13H18 |
ABC2D4E13F18 |
-120.61 |
2.04 |
-9.72 |
-1.27 |
0 |
|
|
242729 |
99205888 |
1 |
BrNS2O4C13H18 |
ABC2D4E13F18 |
-118.93 |
1.98 |
-9.53 |
-1.32 |
0 |
|
|
242730 |
99205890 |
1 |
BrNS2O5C15H16 |
ABC2D5E15F16 |
-113.51 |
7.47 |
-9.7 |
-1.36 |
0 |
|
|
242731 |
99205892 |
1 |
SO2N4C19H34 |
AB2C4D19E34 |
-81.64 |
4.94 |
-8.18 |
0.27 |
0 |
|
|
242732 |
99205893 |
1 |
SO2N4C19H34 |
AB2C4D19E34 |
-81.71 |
5.07 |
-7.96 |
0.26 |
0 |
|
|
242733 |
99205896 |
1 |
BrNS3O4C14H16 |
ABC3D4E14F16 |
-110.66 |
3.35 |
-9.11 |
-1.35 |
0 |
|
|
242734 |
99205904 |
1 |
S2O3N5C14H19 |
A2B3C5D14E19 |
-61.94 |
10.28 |
-8.84 |
-0.24 |
0 |
|
|
242735 |
99205912 |
1 |
SN5O5C24H27 |
AB5C5D24E27 |
-125.62 |
4.79 |
-8.54 |
-1.03 |
0 |
|
|
242736 |
99205913 |
1 |
SN5O5C24H27 |
AB5C5D24E27 |
-123.71 |
7.93 |
-8.49 |
-1.09 |
0 |
|
|
242737 |
99205916 |
1 |
FSN4O4C23H27 |
ABC4D4E23F27 |
-139.12 |
12.37 |
-9.0 |
-0.87 |
0 |
|
|
242738 |
99205951 |
1 |
BrSN2O3C18H21 |
ABC2D3E18F21 |
-73.26 |
4.98 |
-8.44 |
-0.79 |
0 |
|
|
242739 |
99205959 |
1 |
BrSN2O2C20H23 |
ABC2D2E20F23 |
-66.07 |
9.12 |
-8.9 |
-0.38 |
0 |