List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
50566 |
12013114 |
1 |
ON2H22C23 |
AB2C22D23 |
38.4 |
4.05 |
-9.23 |
-0.29 |
0 |
|
|
50567 |
12013115 |
1 |
ON2C20H24 |
AB2C20D24 |
-5.25 |
3.4 |
-9.35 |
0.14 |
0 |
|
|
50568 |
12013116 |
1 |
N2O2H20C21 |
A2B2C20D21 |
4.13 |
4.28 |
-9.14 |
-0.16 |
0 |
|
|
50569 |
12013118 |
1 |
ON2C12H14 |
AB2C12D14 |
-15.16 |
3.73 |
-9.5 |
0.03 |
0 |
|
|
50570 |
12013119 |
1 |
N2O4C11H12 |
A2B4C11D12 |
-138.58 |
0.48 |
-9.64 |
-0.62 |
0 |
|
|
50571 |
12013120 |
1 |
NOSC14H21 |
ABCD14E21 |
-31.82 |
1.09 |
-8.7 |
0.07 |
0 |
|
|
50572 |
12013121 |
1 |
NOSeC17H19 |
ABCD17E19 |
16.3 |
2.71 |
-8.31 |
-0.04 |
0 |
|
|
50573 |
12013122 |
1 |
NOSeC14H21 |
ABCD14E21 |
-23.2 |
2.2 |
-8.32 |
-0.24 |
0 |
|
|
50574 |
12013124 |
1 |
BrNOH14C16 |
ABCD14E16 |
26.28 |
1.07 |
-9.48 |
-0.63 |
0 |
|
|
50575 |
12013125 |
1 |
NO3C14H17 |
AB3C14D17 |
-59.31 |
2.92 |
-10.01 |
-0.91 |
0 |
|
|
50576 |
12013126 |
1 |
FNO3C14H16 |
ABC3D14E16 |
-107.69 |
3.24 |
-10.21 |
-1.08 |
0 |
|
|
50577 |
12013127 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-67.67 |
1.93 |
-9.82 |
-0.88 |
0 |
|
|
50578 |
12013128 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-69.53 |
3.41 |
-9.96 |
-1.17 |
0 |
|
|
50579 |
12013129 |
1 |
NCl2O3C13H13 |
AB2C3D13E13 |
-69.35 |
4.81 |
-9.78 |
-1.3 |
0 |
|
|
50580 |
12013130 |
1 |
ClNO2H6C10 |
ABC2D6E10 |
12.92 |
2.57 |
-9.77 |
-1.08 |
0 |
|
|
50581 |
12013131 |
1 |
NCl2O2H7C11 |
AB2C2D7E11 |
-3.49 |
3.41 |
-9.77 |
-1.34 |
0 |
|
|
50582 |
12013132 |
1 |
O2C17H18 |
A2B17C18 |
-49.01 |
2.44 |
-8.48 |
-0.48 |
0 |
|
|
50583 |
12013133 |
1 |
NO2F3H8C12 |
AB2C3D8E12 |
-144.07 |
2.89 |
-9.83 |
-1.31 |
0 |
|
|
50584 |
12013134 |
1 |
ClNO3C13H14 |
ABC3D13E14 |
-64.25 |
3.8 |
-9.94 |
-1.09 |
0 |
|
|
50585 |
12013135 |
1 |
ClNO2H8C11 |
ABC2D8E11 |
1.64 |
2.32 |
-9.88 |
-1.17 |
0 |
|
|
50586 |
12013136 |
1 |
ClNO2F3H5C11 |
ABC2D3E5F11 |
-143.52 |
1.1 |
-10.12 |
-1.62 |
0 |
|
|
50587 |
12013137 |
1 |
ON3C15H15 |
AB3C15D15 |
42.34 |
1.85 |
-8.52 |
-0.67 |
0 |
|
|
50588 |
12013138 |
1 |
ON3H13C14 |
AB3C13D14 |
49.3 |
2.31 |
-8.58 |
-0.69 |
0 |
|
|
50589 |
12013139 |
1 |
ClN3H10C13 |
AB3C10D13 |
80.71 |
4.61 |
-9.11 |
-0.97 |
0 |
|
|
50590 |
12013140 |
1 |
ON3H17C20 |
AB3C17D20 |
77.0 |
1.85 |
-8.55 |
-0.68 |
0 |
|
|
50591 |
12013141 |
1 |
ON3H13C14 |
AB3C13D14 |
50.44 |
4.1 |
-8.74 |
-0.85 |
0 |
|
|
50592 |
12013143 |
1 |
O2N3C15H15 |
A2B3C15D15 |
16.44 |
2.57 |
-8.19 |
-0.74 |
0 |
|
|
50593 |
12013144 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-19.18 |
4.42 |
-8.01 |
-0.82 |
0 |
|
|
50594 |
12013146 |
1 |
ON3C17H19 |
AB3C17D19 |
32.48 |
1.78 |
-8.52 |
-0.67 |
0 |
|
|
50595 |
12013148 |
1 |
NH13C16 |
AB13C16 |
163.03 |
2.5 |
-8.3 |
-0.15 |
0 |
|
|
50596 |
12013149 |
1 |
OH20C22 |
AB20C22 |
20.71 |
2.17 |
-8.24 |
-0.36 |
0 |
|
|
50597 |
12013151 |
1 |
NPO5C26H38 |
ABC5D26E38 |
-265.38 |
4.89 |
-9.35 |
0.19 |
0 |
|
|
50598 |
12013153 |
1 |
SnCl3C5H7 |
AB3C5D7 |
-59.03 |
4.75 |
-10.14 |
-2.1 |
0 |
|
|
50599 |
12013154 |
1 |
SbCl2C5H7 |
AB2C5D7 |
-20.12 |
3.22 |
-9.88 |
-0.89 |
0 |
|
|
50600 |
12013155 |
1 |
SiSnCl3C8H15 |
ABC3D8E15 |
-99.65 |
5.85 |
-9.89 |
-1.89 |
0 |
|
|
50601 |
12013156 |
1 |
SbSiCl2C8H15 |
ABC2D8E15 |
-66.63 |
5.51 |
-9.27 |
-0.36 |
0 |
|
|
50602 |
12013157 |
1 |
BrIF2H6C12 |
ABC2D6E12 |
-26.9 |
2.82 |
-9.5 |
-1.04 |
0 |
|
|
50603 |
12013158 |
1 |
BrICl2H6C12 |
ABC2D6E12 |
51.82 |
2.75 |
-9.49 |
-1.11 |
0 |
|
|
50604 |
12013159 |
1 |
FBr2H7C12 |
AB2C7D12 |
5.38 |
1.49 |
-9.61 |
-0.55 |
0 |
|
|
50605 |
12013160 |
1 |
FP2C36H51 |
AB2C36D51 |
-93.58 |
3.04 |
-8.04 |
-0.15 |
0 |
|
|
50606 |
12013162 |
1 |
NO5C16H23 |
AB5C16D23 |
-202.12 |
2.11 |
-8.09 |
0.29 |
0 |
|
|
50607 |
12013163 |
1 |
O2S2N5C12H13 |
A2B2C5D12E13 |
17.17 |
5.45 |
-8.78 |
-1.63 |
0 |
|
|
50608 |
12013164 |
1 |
O2S2Cl3N5C13H14 |
A2B2C3D5E13F14 |
-3.92 |
5.01 |
-8.73 |
-1.55 |
0 |
|
|
50609 |
12013165 |
1 |
O2S2N5C12H15 |
A2B2C5D12E15 |
-15.82 |
4.31 |
-8.22 |
-1.06 |
0 |
|
|
50610 |
12013166 |
1 |
O2S2N5C13H17 |
A2B2C5D13E17 |
-22.8 |
7.64 |
-8.21 |
-1.03 |
0 |
|
|
50611 |
12013167 |
1 |
O2S2N5C14H19 |
A2B2C5D14E19 |
-29.71 |
4.63 |
-8.16 |
-1.02 |
0 |
|
|
50612 |
12013168 |
1 |
N2O4C19H24 |
A2B4C19D24 |
-121.27 |
2.99 |
-8.49 |
-0.42 |
0 |
|
|
50613 |
12013170 |
2 |
NO3C11H14 |
AB3C11D14 |
-202.49 |
7.48 |
-8.69 |
-0.44 |
0 |
|
|
50614 |
12013171 |
1 |
N2O7C24H34 |
A2B7C24D34 |
-249.81 |
7.21 |
-8.59 |
-0.1 |
0 |
|
|
50615 |
12013172 |
1 |
SO4N6C22H30 |
AB4C6D22E30 |
-72.43 |
7.61 |
-8.61 |
-1.3 |
0 |