List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
207095 |
80346077 |
2 |
ON2C5H7 |
AB2C5D7 |
-17.1 |
0.88 |
-9.76 |
-1.06 |
0 |
|
|
207096 |
80346078 |
3 |
ClNC5H6 |
ABC5D6 |
8.45 |
5.93 |
-9.13 |
-0.93 |
0 |
|
|
207097 |
80346079 |
1 |
SN2Cl3H13C15 |
AB2C3D13E15 |
37.08 |
4.06 |
-9.15 |
-1.02 |
0 |
|
|
207098 |
80346080 |
1 |
SN2Cl3H13C15 |
AB2C3D13E15 |
38.84 |
4.29 |
-9.2 |
-0.89 |
0 |
|
|
207099 |
80346395 |
1 |
ClN3H12C15 |
AB3C12D15 |
75.42 |
3.14 |
-8.49 |
-0.94 |
0 |
|
|
207100 |
80346396 |
1 |
ClN2O2C11H13 |
AB2C2D11E13 |
-63.22 |
0.71 |
-8.63 |
-0.27 |
0 |
|
|
207101 |
80346822 |
1 |
NO2F3C12H14 |
AB2C3D12E14 |
-223.24 |
2.63 |
-9.46 |
-0.53 |
0 |
|
|
207102 |
80347026 |
1 |
ON5C14H17 |
AB5C14D17 |
38.19 |
6.68 |
-8.63 |
-0.67 |
0 |
|
|
207103 |
80347412 |
1 |
ON4C12H20 |
AB4C12D20 |
-12.6 |
4.6 |
-8.99 |
-0.52 |
0 |
|
|
207104 |
80347413 |
2 |
NOC7H11 |
ABC7D11 |
-68.43 |
3.5 |
-8.98 |
0.12 |
0 |
|
|
207105 |
80347414 |
1 |
ON4C12H20 |
AB4C12D20 |
-12.74 |
5.46 |
-8.64 |
-0.07 |
0 |
|
|
207106 |
80347767 |
1 |
ON6C13H18 |
AB6C13D18 |
33.27 |
7.25 |
-8.92 |
-0.71 |
0 |
|
|
207107 |
80347768 |
1 |
OSN5C11H15 |
ABC5D11E15 |
41.79 |
4.01 |
-8.75 |
-0.18 |
0 |
|
|
207108 |
80347980 |
2 |
NOC7H10 |
ABC7D10 |
-62.81 |
2.31 |
-8.86 |
-0.02 |
0 |
|
|
207109 |
80347981 |
1 |
ON6C13H22 |
AB6C13D22 |
15.68 |
5.62 |
-8.72 |
-0.65 |
0 |
|
|
207110 |
80348015 |
1 |
SN3O3C10H13 |
AB3C3D10E13 |
-89.03 |
3.44 |
-9.31 |
-1.38 |
0 |
|
|
207111 |
80348016 |
1 |
SN3O3H9C12 |
AB3C3D9E12 |
-53.16 |
3.51 |
-9.46 |
-1.46 |
0 |
|
|
207112 |
80348246 |
2 |
ON2C7H10 |
AB2C7D10 |
-40.74 |
6.34 |
-8.9 |
-0.61 |
0 |
|
|
207113 |
80348262 |
1 |
BrO2N3H12C13 |
AB2C3D12E13 |
0.36 |
1.29 |
-9.75 |
-1.25 |
0 |
|
|
207114 |
80348291 |
1 |
ON3C16H27 |
AB3C16D27 |
-16.11 |
3.46 |
-8.72 |
0.02 |
0 |
|
|
207115 |
80348499 |
1 |
SN2O3C11H14 |
AB2C3D11E14 |
-104.29 |
3.24 |
-9.07 |
-1.03 |
0 |
|
|
207116 |
80349567 |
1 |
ON5C14H23 |
AB5C14D23 |
-2.47 |
4.7 |
-8.84 |
-0.5 |
0 |
|
|
207117 |
80349568 |
1 |
ON5C13H21 |
AB5C13D21 |
1.43 |
4.77 |
-8.68 |
-0.59 |
0 |
|
|
207118 |
80349569 |
1 |
ON5C13H21 |
AB5C13D21 |
-3.14 |
2.64 |
-8.93 |
-0.8 |
0 |
|
|
207119 |
80349956 |
2 |
ClNOH6C7 |
ABCD6E7 |
14.95 |
6.07 |
-9.11 |
-1.4 |
0 |
|
|
207120 |
80350178 |
1 |
NCl2O2C11H13 |
AB2C2D11E13 |
-81.31 |
5.24 |
-8.45 |
-0.34 |
0 |
|
|
207121 |
80350179 |
1 |
NOCl2C13H17 |
ABC2D13E17 |
-59.08 |
4.65 |
-8.35 |
-0.23 |
0 |
|
|
207122 |
80350242 |
1 |
OCl2N2C14H20 |
AB2C2D14E20 |
-67.76 |
6.13 |
-8.26 |
-0.12 |
0 |
|
|
207123 |
80350243 |
1 |
BrOCl2N2H11C13 |
ABC2D2E11F13 |
-1.36 |
4.97 |
-8.33 |
-0.51 |
0 |
|
|
207124 |
80350244 |
1 |
OCl2N3C13H19 |
AB2C3D13E19 |
-44.05 |
5.74 |
-8.63 |
-0.44 |
0 |
|
|
207125 |
80350352 |
1 |
NSCl2O4H7C9 |
ABC2D4E7F9 |
-85.18 |
6.57 |
-9.85 |
-2.36 |
0 |
|
|
207126 |
80350440 |
1 |
Cl2O2N3H11C13 |
A2B2C3D11E13 |
25.83 |
7.42 |
-9.11 |
-1.42 |
0 |
|
|
207127 |
80350518 |
1 |
NOSCl2H11C13 |
ABCD2E11F13 |
-9.87 |
4.19 |
-8.75 |
-0.65 |
0 |
|
|
207128 |
80351129 |
2 |
ClNC6H8 |
ABC6D8 |
12.44 |
4.11 |
-8.45 |
-0.22 |
0 |
|
|
207129 |
80351194 |
1 |
ClON3C14H20 |
ABC3D14E20 |
-17.8 |
2.78 |
-9.14 |
-0.99 |
0 |
|
|
207130 |
80351612 |
1 |
ON3C10H19 |
AB3C10D19 |
-23.37 |
3.57 |
-8.86 |
0.83 |
0 |
|
|
207131 |
80351863 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-102.6 |
4.43 |
-8.34 |
0.25 |
0 |
|
|
207132 |
80351864 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-93.47 |
3.26 |
-8.77 |
-0.13 |
0 |
|
|
207133 |
80351865 |
1 |
SN2O4C13H18 |
AB2C4D13E18 |
-156.59 |
6.68 |
-9.03 |
-0.38 |
0 |
|
|
207134 |
80351896 |
1 |
FN3C14H18 |
AB3C14D18 |
5.84 |
5.03 |
-8.98 |
0.15 |
0 |
|
|
207135 |
80351897 |
1 |
ClSN3C11H12 |
ABC3D11E12 |
50.96 |
2.81 |
-9.0 |
-0.47 |
0 |
|
|
207136 |
80352258 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-119.61 |
5.04 |
-9.86 |
0.31 |
0 |
|
|
207137 |
80352309 |
1 |
BrN2S2O3C9H9 |
AB2C2D3E9F9 |
-25.15 |
2.45 |
-9.78 |
-0.95 |
0 |
|
|
207138 |
80352328 |
2 |
NOC8H15 |
ABC8D15 |
-123.55 |
2.88 |
-8.85 |
0.78 |
0 |
|
|
207139 |
80352329 |
2 |
NOC8H15 |
ABC8D15 |
-120.87 |
3.5 |
-8.66 |
0.77 |
0 |
|
|
207140 |
80352330 |
1 |
N2O2C11H22 |
A2B2C11D22 |
-105.88 |
3.76 |
-9.03 |
0.67 |
0 |
|
|
207141 |
80352580 |
1 |
ON6C10H12 |
AB6C10D12 |
53.42 |
5.23 |
-9.52 |
-0.98 |
0 |
|
|
207142 |
80352581 |
2 |
ON2C6H9 |
AB2C6D9 |
-51.46 |
5.2 |
-9.1 |
-0.7 |
0 |
|
|
207143 |
80352610 |
1 |
OSN5C12H15 |
ABC5D12E15 |
30.31 |
5.33 |
-9.11 |
-0.84 |
0 |
|
|
207144 |
80352700 |
1 |
O2N5C11H17 |
A2B5C11D17 |
-48.85 |
2.89 |
-9.28 |
-0.85 |
0 |