List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
285025 |
104091250 |
1 |
NO2C12H21 |
AB2C12D21 |
-57.33 |
2.28 |
-8.67 |
1.71 |
0 |
|
|
285026 |
104091273 |
1 |
ON3C8H11 |
AB3C8D11 |
40.46 |
2.34 |
-10.48 |
-0.14 |
0 |
|
|
285027 |
104091710 |
1 |
BrNSC13H18 |
ABCD13E18 |
58.9 |
1.23 |
-9.28 |
-0.59 |
0 |
|
|
285028 |
104091711 |
1 |
NOC10H19 |
ABC10D19 |
-32.19 |
2.14 |
-9.4 |
1.77 |
0 |
|
|
285029 |
104091801 |
2 |
N2C5H8 |
A2B5C8 |
72.77 |
4.03 |
-9.66 |
0.15 |
0 |
|
|
285030 |
104091802 |
1 |
N4C11H18 |
A4B11C18 |
79.42 |
2.7 |
-9.6 |
0.18 |
0 |
|
|
285031 |
104091932 |
2 |
NC8H15 |
AB8C15 |
16.51 |
2.11 |
-8.38 |
1.91 |
0 |
|
|
285032 |
104092004 |
1 |
NC13H25 |
AB13C25 |
-8.06 |
2.64 |
-8.77 |
1.97 |
0 |
|
|
285033 |
104092005 |
1 |
NO2C9H17 |
AB2C9D17 |
-60.87 |
2.49 |
-9.59 |
1.72 |
0 |
|
|
285034 |
104092006 |
1 |
NO2C10H19 |
AB2C10D19 |
-60.89 |
0.9 |
-9.08 |
1.67 |
0 |
|
|
285035 |
104092307 |
1 |
NOC11H13 |
ABC11D13 |
18.24 |
4.81 |
-9.36 |
-0.43 |
0 |
|
|
285036 |
104092308 |
1 |
NO2C11H13 |
AB2C11D13 |
-16.69 |
2.97 |
-9.31 |
-0.4 |
0 |
|
|
285037 |
104092427 |
2 |
OC7H8 |
AB7C8 |
-44.52 |
3.4 |
-8.44 |
0.08 |
0 |
|
|
285038 |
104092567 |
1 |
NO3C14H17 |
AB3C14D17 |
-39.39 |
1.7 |
-8.29 |
-0.11 |
0 |
|
|
285039 |
104092610 |
1 |
ClNSO2H12C13 |
ABCD2E12F13 |
-16.13 |
9.43 |
-9.53 |
-0.93 |
0 |
|
|
285040 |
104092708 |
1 |
OSC12H14 |
ABC12D14 |
29.96 |
1.64 |
-8.7 |
-0.18 |
0 |
|
|
285041 |
104092711 |
2 |
BrOC6H6 |
ABC6D6 |
-12.56 |
1.1 |
-8.61 |
-0.63 |
0 |
|
|
285042 |
104092712 |
1 |
NO3C12H13 |
AB3C12D13 |
22.35 |
7.07 |
-9.53 |
-1.12 |
0 |
|
|
285043 |
104092714 |
1 |
N2O2C11H16 |
A2B2C11D16 |
-33.23 |
6.85 |
-9.64 |
0.07 |
0 |
|
|
285044 |
104092725 |
1 |
NO2C14H15 |
AB2C14D15 |
-11.53 |
1.63 |
-8.66 |
-0.3 |
0 |
|
|
285045 |
104092925 |
1 |
ON3C15H19 |
AB3C15D19 |
10.27 |
3.09 |
-9.41 |
-0.48 |
0 |
|
|
285046 |
104092927 |
1 |
ON4C14H14 |
AB4C14D14 |
58.49 |
4.43 |
-9.5 |
-1.27 |
0 |
|
|
285047 |
104093117 |
1 |
O3N4C14H16 |
A3B4C14D16 |
-41.86 |
4.73 |
-9.4 |
-0.67 |
0 |
|
|
285048 |
104093123 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
-11.16 |
4.87 |
-9.36 |
-0.49 |
0 |
|
|
285049 |
104093182 |
1 |
ON3C16H23 |
AB3C16D23 |
0.08 |
5.83 |
-9.54 |
-0.1 |
0 |