List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
209995 |
80748923 |
1 |
BrN4C16H21 |
AB4C16D21 |
46.41 |
5.37 |
-8.41 |
-0.57 |
0 |
|
|
209996 |
80748924 |
1 |
BrO2N5C13H14 |
AB2C5D13E14 |
35.56 |
3.3 |
-9.11 |
-1.4 |
0 |
|
|
209997 |
80748972 |
1 |
NO5C9H15 |
AB5C9D15 |
-236.86 |
4.29 |
-10.3 |
0.1 |
0 |
|
|
209998 |
80749167 |
1 |
BrN6C14H17 |
AB6C14D17 |
58.61 |
3.64 |
-8.67 |
-0.31 |
0 |
|
|
209999 |
80749168 |
1 |
BrN4C16H21 |
AB4C16D21 |
32.18 |
6.33 |
-8.43 |
-0.29 |
0 |
|
|
210000 |
80749169 |
1 |
N2O6C11H14 |
A2B6C11D14 |
-233.79 |
7.92 |
-10.12 |
-0.4 |
0 |
|
|
210001 |
80749237 |
1 |
NO2C12H19 |
AB2C12D19 |
-89.68 |
2.24 |
-8.54 |
0.8 |
0 |
|
|
210002 |
80749238 |
1 |
NO2C13H21 |
AB2C13D21 |
-94.69 |
2.37 |
-8.55 |
0.8 |
0 |
|
|
210003 |
80749353 |
1 |
NO2C15H23 |
AB2C15D23 |
-96.32 |
3.0 |
-8.4 |
0.87 |
0 |
|
|
210004 |
80749354 |
2 |
NOC7H12 |
ABC7D12 |
-82.77 |
2.78 |
-8.33 |
0.94 |
0 |
|
|
210005 |
80749355 |
2 |
NOC7H12 |
ABC7D12 |
-87.45 |
1.06 |
-8.37 |
0.95 |
0 |
|
|
210006 |
80749982 |
1 |
O2N4C15H18 |
A2B4C15D18 |
35.58 |
5.7 |
-8.58 |
-0.97 |
0 |
|
|
210007 |
80749983 |
1 |
N2O5C10H18 |
A2B5C10D18 |
-230.97 |
2.16 |
-9.3 |
-0.02 |
0 |
|
|
210008 |
80750297 |
1 |
N4C17H24 |
A4B17C24 |
19.79 |
2.8 |
-8.25 |
-0.22 |
0 |
|
|
210009 |
80750408 |
1 |
ON5C15H17 |
AB5C15D17 |
9.87 |
5.25 |
-8.49 |
-0.43 |
0 |
|
|
210010 |
80750618 |
1 |
O2N3C16H19 |
A2B3C16D19 |
17.84 |
4.46 |
-8.3 |
-0.68 |
0 |
|
|
210011 |
80750822 |
1 |
SN2O5C7H12 |
AB2C5D7E12 |
-190.79 |
6.14 |
-10.54 |
-1.07 |
0 |
|
|
210012 |
80750823 |
1 |
ON8C12H18 |
AB8C12D18 |
58.74 |
4.83 |
-9.37 |
-0.9 |
0 |
|
|
210013 |
80750926 |
1 |
N4C17H24 |
A4B17C24 |
27.22 |
3.65 |
-8.39 |
0.0 |
0 |
|
|
210014 |
80750927 |
2 |
NO2C5H6 |
AB2C5D6 |
-148.2 |
7.93 |
-10.21 |
-1.3 |
0 |
|
|
210015 |
80751026 |
1 |
N2O4C9H18 |
A2B4C9D18 |
-199.19 |
3.91 |
-9.54 |
0.08 |
0 |
|
|
210016 |
80751027 |
1 |
N2O4C9H18 |
A2B4C9D18 |
-199.36 |
5.4 |
-10.05 |
0.02 |
0 |
|
|
210017 |
80751028 |
1 |
SN2O4C7H12 |
AB2C4D7E12 |
-170.96 |
4.17 |
-9.43 |
-0.39 |
0 |
|
|
210018 |
80751258 |
1 |
NSCl2O5C9H9 |
ABC2D5E9F9 |
-194.29 |
5.33 |
-10.22 |
-1.57 |
0 |
|
|
210019 |
80751554 |
1 |
N2O5C13H14 |
A2B5C13D14 |
-146.58 |
2.98 |
-9.57 |
-0.85 |
0 |
|
|
210020 |
80751591 |
1 |
NSO5C13H19 |
ABC5D13E19 |
-216.97 |
3.52 |
-9.19 |
-0.56 |
0 |
|
|
210021 |
80751658 |
1 |
F2N4C15H18 |
A2B4C15D18 |
-56.84 |
6.79 |
-8.83 |
-0.49 |
0 |
|
|
210022 |
80751659 |
1 |
F2N4C15H18 |
A2B4C15D18 |
-56.81 |
6.65 |
-8.85 |
-0.53 |
0 |
|
|
210023 |
80751660 |
1 |
N3O6C10H13 |
A3B6C10D13 |
-248.81 |
5.25 |
-10.31 |
-0.93 |
0 |
|
|
210024 |
80751661 |
2 |
NSO2C6H6 |
ABC2D6E6 |
-122.7 |
5.64 |
-9.28 |
-1.19 |
0 |
|
|
210025 |
80751662 |
1 |
SN2O7C10H14 |
AB2C7D10E14 |
-250.12 |
6.52 |
-10.05 |
-1.44 |
0 |
|
|
210026 |
80752064 |
1 |
ClFN3H7C9 |
ABC3D7E9 |
12.83 |
3.16 |
-9.1 |
-0.78 |
0 |
|
|
210027 |
80752470 |
1 |
N2O4C15H16 |
A2B4C15D16 |
-110.15 |
2.97 |
-8.6 |
-0.55 |
0 |
|
|
210028 |
80752471 |
1 |
ClON3C13H22 |
ABC3D13E22 |
-36.67 |
4.16 |
-8.8 |
-0.46 |
0 |
|
|
210029 |
80752472 |
1 |
ClON3C11H18 |
ABC3D11E18 |
-27.35 |
1.65 |
-8.98 |
-0.54 |
0 |
|
|
210030 |
80752992 |
1 |
BrClON3C10H15 |
ABCD3E10F15 |
-15.23 |
1.6 |
-8.87 |
-0.64 |
0 |
|
|
210031 |
80753229 |
1 |
FNOH12C13 |
ABCD12E13 |
-48.8 |
5.02 |
-8.8 |
-0.03 |
0 |
|
|
210032 |
80753386 |
1 |
FSO2N3H8C14 |
ABC2D3E8F14 |
39.2 |
5.98 |
-9.5 |
-1.8 |
0 |
|
|
210033 |
80753405 |
1 |
OCl2N3C8H11 |
AB2C3D8E11 |
-31.54 |
1.45 |
-9.14 |
-0.39 |
0 |
|
|
210034 |
80753406 |
1 |
OCl2N3C10H13 |
AB2C3D10E13 |
-20.57 |
0.67 |
-9.06 |
-0.33 |
0 |
|
|
210035 |
80753407 |
1 |
OCl2N3C11H15 |
AB2C3D11E15 |
-15.92 |
2.04 |
-8.94 |
-0.31 |
0 |
|
|
210036 |
80753491 |
1 |
ClN5C14H16 |
AB5C14D16 |
60.63 |
1.96 |
-8.66 |
-0.06 |
0 |
|
|
210037 |
80753492 |
1 |
N4C13H14 |
A4B13C14 |
55.75 |
4.47 |
-8.31 |
-0.13 |
0 |
|
|
210038 |
80753577 |
4 |
NC4H5 |
AB4C5 |
47.15 |
1.97 |
-8.17 |
0.02 |
0 |
|
|
210039 |
80753578 |
1 |
N4C13H18 |
A4B13C18 |
40.05 |
3.09 |
-8.56 |
-0.53 |
0 |
|
|
210040 |
80753579 |
2 |
N2C5H9 |
A2B5C9 |
7.57 |
3.49 |
-8.7 |
0.38 |
0 |
|
|
210041 |
80753580 |
3 |
NC4H7 |
AB4C7 |
4.57 |
0.98 |
-8.04 |
0.65 |
0 |
|
|
210042 |
80753581 |
2 |
N2C5H9 |
A2B5C9 |
18.65 |
4.8 |
-8.73 |
0.27 |
0 |
|
|
210043 |
80753582 |
1 |
N4C13H24 |
A4B13C24 |
0.58 |
2.36 |
-8.51 |
0.32 |
0 |
|
|
210044 |
80753626 |
1 |
OF2N4C12H12 |
AB2C4D12E12 |
-83.69 |
1.1 |
-8.71 |
-0.52 |
0 |