List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
337193 |
127256758 |
1 |
NO2C10H19 |
AB2C10D19 |
-75.94 |
2.41 |
-9.98 |
-0.25 |
0 |
|
|
337194 |
127256759 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-88.76 |
6.94 |
-8.79 |
-0.22 |
0 |
|
|
337195 |
127256760 |
1 |
N2O9C28H30 |
A2B9C28D30 |
-331.93 |
6.29 |
-9.19 |
-0.63 |
0 |
|
|
337196 |
127256761 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-20.23 |
6.44 |
-8.59 |
-0.73 |
0 |
|
|
337197 |
127256762 |
1 |
NO3C15H31 |
AB3C15D31 |
-187.21 |
4.16 |
-9.23 |
1.82 |
0 |
|
|
337198 |
127256763 |
1 |
NO3C14H29 |
AB3C14D29 |
-182.85 |
1.14 |
-9.17 |
1.84 |
0 |
|
|
337199 |
127256764 |
1 |
NO3C9H19 |
AB3C9D19 |
-158.27 |
3.12 |
-9.07 |
1.94 |
0 |
|
|
337200 |
127256765 |
1 |
NO3C15H31 |
AB3C15D31 |
-186.49 |
2.66 |
-9.08 |
1.92 |
0 |
|
|
337201 |
127256766 |
1 |
NO5C13H17 |
AB5C13D17 |
-208.44 |
7.02 |
-9.85 |
-1.37 |
0 |
|
|
337202 |
127256767 |
1 |
NO3C8H17 |
AB3C8D17 |
-150.33 |
1.02 |
-9.14 |
1.96 |
0 |
|
|
337203 |
127256768 |
1 |
NO4C15H21 |
AB4C15D21 |
-162.98 |
3.17 |
-8.69 |
0.27 |
0 |
|
|
337204 |
127256769 |
2 |
NOC9H11 |
ABC9D11 |
-47.04 |
4.09 |
-8.0 |
0.22 |
0 |
|
|
337205 |
127256770 |
1 |
N2O3C9H20 |
A2B3C9D20 |
-153.13 |
1.76 |
-9.09 |
1.78 |
0 |
|
|
337206 |
127256771 |
1 |
NO2C16H21 |
AB2C16D21 |
-74.54 |
7.18 |
-8.31 |
-0.48 |
0 |
|
|
337207 |
127256772 |
1 |
NO2C18H25 |
AB2C18D25 |
-84.58 |
7.28 |
-8.31 |
-0.48 |
0 |
|
|
337208 |
127256773 |
1 |
INO3C23H26 |
ABC3D23E26 |
-33.12 |
10.34 |
-7.26 |
-1.24 |
0 |
|
|
337209 |
127256774 |
1 |
O5C23H28 |
A5B23C28 |
-214.09 |
4.35 |
-9.78 |
-0.74 |
0 |
|
|
337210 |
127256775 |
1 |
ON2C19H22 |
AB2C19D22 |
23.7 |
2.94 |
-8.39 |
0.0 |
0 |
|
|
337211 |
127256776 |
2 |
NOH7C10 |
ABC7D10 |
33.16 |
1.71 |
-8.94 |
-1.58 |
0 |
|
|
337212 |
127256777 |
2 |
NO2C11H12 |
AB2C11D12 |
-95.6 |
5.96 |
-8.57 |
-1.12 |
0 |
|
|
337213 |
127256778 |
1 |
N3O4H13C17 |
A3B4C13D17 |
12.35 |
5.33 |
-9.16 |
-1.88 |
0 |
|
|
337214 |
127256779 |
1 |
N2O7C27H36 |
A2B7C27D36 |
-217.17 |
1.47 |
-10.18 |
-1.84 |
0 |
|
|
337215 |
127256780 |
1 |
Br2S2N5O6C19H27 |
A2B2C5D6E19F27 |
-218.52 |
7.26 |
-8.66 |
-1.41 |
0 |
|
|
337216 |
127256781 |
2 |
NO2C4H5 |
AB2C4D5 |
-134.25 |
4.04 |
-9.16 |
-0.51 |
0 |
|
|
337217 |
127256782 |
1 |
ON2C18H20 |
AB2C18D20 |
0.65 |
5.1 |
-8.11 |
-0.03 |
0 |
|
|
337218 |
127256783 |
1 |
O3H12C16 |
A3B12C16 |
-32.65 |
1.23 |
-8.82 |
-1.01 |
0 |
|
|
337219 |
127256784 |
1 |
ClO2H9C15 |
AB2C9D15 |
-3.86 |
3.5 |
-9.54 |
-1.26 |
0 |
|
|
337220 |
127256785 |
1 |
BrO2H9C15 |
AB2C9D15 |
8.14 |
3.94 |
-9.52 |
-1.27 |
0 |
|
|
337221 |
127256786 |
3 |
OC4H4 |
AB4C4 |
-86.89 |
3.43 |
-9.46 |
-0.95 |
0 |
|
|
337222 |
127256787 |
1 |
NSO3H15C16 |
ABC3D15E16 |
-63.73 |
3.64 |
-8.18 |
-0.97 |
0 |
|
|
337223 |
127256788 |
1 |
NSO3C11H11 |
ABC3D11E11 |
-86.44 |
2.87 |
-8.71 |
-0.48 |
0 |
|
|
337224 |
127256789 |
1 |
NSO3C12H13 |
ABC3D12E13 |
-97.47 |
3.0 |
-8.75 |
-0.54 |
0 |
|
|
337225 |
127256790 |
1 |
NSO3H11C14 |
ABC3D11E14 |
-49.47 |
3.98 |
-8.51 |
-1.08 |
0 |
|
|
337226 |
127256791 |
1 |
NSO3C11H11 |
ABC3D11E11 |
-94.17 |
3.17 |
-8.75 |
-0.54 |
0 |
|
|
337227 |
127256792 |
1 |
NSO3C11H13 |
ABC3D11E13 |
-96.54 |
1.16 |
-8.55 |
-0.31 |
0 |
|
|
337228 |
127256793 |
1 |
N2O4S4C19H20 |
A2B4C4D19E20 |
-88.65 |
6.22 |
-8.32 |
-1.59 |
0 |
|
|
337229 |
127256794 |
1 |
NSO3C12H13 |
ABC3D12E13 |
-83.02 |
3.59 |
-8.32 |
-0.12 |
0 |
|
|
337230 |
127256795 |
1 |
N2O3S3H16C17 |
A2B3C3D16E17 |
-60.21 |
4.64 |
-8.35 |
-1.54 |
0 |
|
|
337231 |
127256796 |
1 |
NO4C12H13 |
AB4C12D13 |
-128.31 |
2.77 |
-8.98 |
-0.43 |
0 |
|
|
337232 |
127256797 |
1 |
NSO3H13C15 |
ABC3D13E15 |
-40.26 |
2.82 |
-8.87 |
-1.55 |
0 |
|
|
337233 |
127256798 |
1 |
ClN2O4H9C13 |
AB2C4D9E13 |
-99.3 |
2.43 |
-8.93 |
-1.21 |
0 |
|
|
337234 |
127256799 |
1 |
NOC9H15 |
ABC9D15 |
-70.11 |
4.68 |
-9.22 |
1.24 |
0 |
|
|
337235 |
127256800 |
1 |
ON4H14C17 |
AB4C14D17 |
98.88 |
11.03 |
-8.62 |
-1.43 |
0 |
|
|
337236 |
127256801 |
1 |
O2N4C13H14 |
A2B4C13D14 |
25.44 |
9.01 |
-8.71 |
-1.34 |
0 |
|
|
337237 |
127256802 |
2 |
ON2H8C9 |
AB2C8D9 |
58.33 |
11.79 |
-8.52 |
-1.37 |
0 |
|
|
337238 |
127256803 |
1 |
OSN2C14H14 |
ABC2D14E14 |
39.15 |
2.78 |
-8.56 |
-0.74 |
0 |
|
|
337239 |
127256804 |
1 |
NF3O3C14H14 |
AB3C3D14E14 |
-260.91 |
10.37 |
-8.99 |
-0.92 |
0 |
|
|
337240 |
127256805 |
1 |
O2N5C23H25 |
A2B5C23D25 |
59.14 |
3.9 |
-8.29 |
-1.24 |
0 |
|
|
337241 |
127256806 |
1 |
S2N3O3C20H21 |
A2B3C3D20E21 |
10.74 |
8.51 |
-9.08 |
-1.22 |
0 |
|
|
337242 |
127256807 |
1 |
O3N9C29H29 |
A3B9C29D29 |
40.52 |
2.53 |
-8.01 |
-1.31 |
0 |