List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
303543 |
124489881 |
1 |
BrN2O3H15C16 |
AB2C3D15E16 |
-89.3 |
4.27 |
-8.98 |
-1.0 |
0 |
|
|
303544 |
124489882 |
1 |
BrN2O3H15C16 |
AB2C3D15E16 |
-88.4 |
5.39 |
-9.01 |
-0.96 |
0 |
|
|
303545 |
124489883 |
1 |
BrN2O3H15C16 |
AB2C3D15E16 |
-82.53 |
5.76 |
-9.18 |
-0.84 |
0 |
|
|
303546 |
124489884 |
1 |
BrN3O4H12C14 |
AB3C4D12E14 |
-39.56 |
7.04 |
-9.07 |
-1.44 |
0 |
|
|
303547 |
124489885 |
1 |
BrON2C19H21 |
ABC2D19E21 |
-11.34 |
2.15 |
-8.77 |
-0.38 |
0 |
|
|
303550 |
124489889 |
2 |
N2O2C11H11 |
A2B2C11D11 |
-130.86 |
3.42 |
-8.86 |
-0.94 |
0 |
|
|
303551 |
124489890 |
2 |
NO2C9H12 |
AB2C9D12 |
-155.11 |
5.19 |
-8.27 |
0.1 |
0 |
|
|
303552 |
124489896 |
1 |
O2N3H27C28 |
A2B3C27D28 |
-11.19 |
7.34 |
-8.32 |
-0.29 |
0 |
|
|
303553 |
124489897 |
1 |
BrO2N3H20C21 |
AB2C3D20E21 |
-22.01 |
7.58 |
-8.76 |
-0.54 |
0 |
|
|
303554 |
124489898 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-81.1 |
3.1 |
-9.16 |
-0.96 |
0 |
|
|
303555 |
124489899 |
1 |
SO3N4C18H18 |
AB3C4D18E18 |
-76.69 |
2.86 |
-9.04 |
-0.97 |
0 |
|
|
303556 |
124489900 |
1 |
N2O4C19H24 |
A2B4C19D24 |
-158.95 |
4.51 |
-8.91 |
-0.55 |
0 |
|
|
303557 |
124489901 |
1 |
N3O5C24H25 |
A3B5C24D25 |
-180.43 |
2.38 |
-9.43 |
-1.01 |
0 |
|
|
303558 |
124489902 |
1 |
N2O4C17H22 |
A2B4C17D22 |
-147.76 |
6.24 |
-8.59 |
-0.23 |
0 |
|
|
303559 |
124489903 |
1 |
N3O5C23H23 |
A3B5C23D23 |
-172.94 |
2.48 |
-9.44 |
-1.0 |
0 |
|
|
303560 |
124489905 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-76.58 |
0.49 |
-9.13 |
-0.91 |
0 |
|
|
303561 |
124489906 |
1 |
ClN2O3C17H21 |
AB2C3D17E21 |
-124.28 |
4.88 |
-8.74 |
-0.4 |
0 |
|
|
303562 |
124489907 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-134.06 |
3.68 |
-8.54 |
-0.87 |
0 |
|
|
303563 |
124489908 |
1 |
N3O4C21H21 |
A3B4C21D21 |
-117.43 |
1.46 |
-8.54 |
-0.85 |
0 |
|
|
303564 |
124489909 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-145.35 |
3.7 |
-8.54 |
-0.86 |
0 |
|
|
303565 |
124489910 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-170.83 |
1.58 |
-8.98 |
-0.82 |
0 |
|
|
303566 |
124489911 |
1 |
N3O4C24H25 |
A3B4C24D25 |
-128.66 |
3.33 |
-9.34 |
-0.99 |
0 |
|
|
303567 |
124489912 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-136.59 |
3.84 |
-8.89 |
-0.91 |
0 |
|
|
303568 |
124489913 |
1 |
N3O4H19C21 |
A3B4C19D21 |
-112.21 |
3.44 |
-9.36 |
-1.01 |
0 |
|
|
303569 |
124489914 |
1 |
BrO2N3H20C21 |
AB2C3D20E21 |
-21.96 |
5.52 |
-8.71 |
-0.51 |
0 |
|
|
303570 |
124489915 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-168.71 |
1.03 |
-8.96 |
-0.87 |
0 |
|
|
303571 |
124489916 |
1 |
N3O4C24H25 |
A3B4C24D25 |
-129.66 |
3.73 |
-9.31 |
-0.99 |
0 |
|
|
303572 |
124489917 |
1 |
N2O6C25H32 |
A2B6C25D32 |
-219.71 |
2.32 |
-8.01 |
0.4 |
0 |
|
|
303573 |
124489918 |
2 |
NO2C9H12 |
AB2C9D12 |
-153.52 |
3.87 |
-8.24 |
-0.01 |
0 |
|
|
303574 |
124489919 |
1 |
N3O4C23H25 |
A3B4C23D25 |
-130.46 |
1.96 |
-8.87 |
-0.88 |
0 |
|
|
303575 |
124489920 |
1 |
BrN2O3C16H19 |
AB2C3D16E19 |
-104.66 |
3.55 |
-9.12 |
-0.77 |
0 |
|
|
303576 |
124489921 |
1 |
ClN2O3C16H19 |
AB2C3D16E19 |
-117.15 |
4.14 |
-9.11 |
-0.72 |
0 |
|
|
303577 |
124489922 |
1 |
FSN2O3C17H19 |
ABC2D3E17F19 |
-148.54 |
7.79 |
-9.57 |
-1.73 |
0 |
|
|
303578 |
124489924 |
1 |
ClSN2O3C17H19 |
ABC2D3E17F19 |
-107.32 |
7.77 |
-9.8 |
-1.34 |
0 |
|
|
303579 |
124489926 |
1 |
N2O7C13H18 |
A2B7C13D18 |
-219.64 |
6.85 |
-9.35 |
-1.34 |
0 |
|
|
303580 |
124489927 |
1 |
O5C20H34 |
A5B20C34 |
-255.69 |
6.72 |
-9.85 |
0.49 |
0 |
|
|
303581 |
124489928 |
1 |
O5C20H34 |
A5B20C34 |
-255.66 |
4.66 |
-9.94 |
0.44 |
0 |
|
|
303582 |
124489929 |
1 |
O5C20H32 |
A5B20C32 |
-247.77 |
6.68 |
-9.04 |
0.49 |
0 |
|
|
303583 |
124489930 |
1 |
O5C20H32 |
A5B20C32 |
-228.11 |
7.0 |
-9.19 |
0.55 |
0 |
|
|
303584 |
124489931 |
1 |
NO7C8H13 |
AB7C8D13 |
-313.86 |
0.7 |
-10.29 |
-0.14 |
0 |
|
|
303585 |
124489932 |
1 |
NO7C8H13 |
AB7C8D13 |
-310.52 |
3.99 |
-10.63 |
0.05 |
0 |
|
|
303586 |
124489933 |
1 |
NO7C8H13 |
AB7C8D13 |
-309.42 |
4.53 |
-10.43 |
0.15 |
0 |
|
|
303589 |
124489936 |
1 |
O8C15H18 |
A8B15C18 |
-307.62 |
6.91 |
-9.48 |
-1.13 |
0 |
|
|
303590 |
124489937 |
1 |
O8C15H18 |
A8B15C18 |
-313.41 |
6.07 |
-9.76 |
-1.23 |
0 |
|
|
303591 |
124489938 |
3 |
NO2C4H7 |
AB2C4D7 |
-247.31 |
6.25 |
-9.94 |
-0.01 |
0 |
|
|
303592 |
124489940 |
1 |
SN4O4C16H28 |
AB4C4D16E28 |
-203.43 |
5.78 |
-9.18 |
-0.05 |
0 |
|
|
303593 |
124489941 |
1 |
SN4O4C16H28 |
AB4C4D16E28 |
-188.9 |
5.47 |
-9.22 |
-0.1 |
0 |
|
|
303594 |
124489942 |
1 |
O8C15H18 |
A8B15C18 |
-311.81 |
5.09 |
-9.65 |
-1.01 |
0 |
|
|
303595 |
124489943 |
1 |
O8C15H18 |
A8B15C18 |
-313.35 |
5.52 |
-9.76 |
-1.09 |
0 |
|
|
303596 |
124489944 |
2 |
O2C10H15 |
A2B10C15 |
-159.14 |
7.92 |
-9.78 |
-1.22 |
0 |