List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
307570 |
125307543 |
1 |
SO2N5C20H27 |
AB2C5D20E27 |
-68.82 |
4.44 |
-8.95 |
-0.28 |
0 |
|
|
307571 |
125307545 |
1 |
SO2N5C20H27 |
AB2C5D20E27 |
-51.42 |
3.59 |
-8.85 |
-0.17 |
0 |
|
|
307572 |
125307547 |
1 |
NO7C33H61 |
AB7C33D61 |
-408.0 |
5.85 |
-9.98 |
0.57 |
0 |
|
|
307573 |
125307548 |
1 |
NO7C33H61 |
AB7C33D61 |
-411.9 |
4.67 |
-9.65 |
0.22 |
0 |
|
|
307574 |
125307549 |
1 |
N3O5C24H25 |
A3B5C24D25 |
-101.55 |
0.8 |
-8.31 |
-1.17 |
0 |
|
|
307577 |
125307560 |
2 |
ON2C6H6 |
AB2C6D6 |
37.81 |
3.69 |
-9.41 |
-1.44 |
0 |
|
|
307578 |
125307561 |
2 |
ON2C6H6 |
AB2C6D6 |
40.7 |
6.51 |
-9.36 |
-1.39 |
0 |
|
|
307579 |
125307563 |
1 |
SO2N6H18C20 |
AB2C6D18E20 |
105.75 |
6.24 |
-8.69 |
-1.4 |
0 |
|
|
307580 |
125307566 |
1 |
FO4N5H18C27 |
AB4C5D18E27 |
-11.89 |
2.61 |
-8.83 |
-1.91 |
0 |
|
|
307582 |
125307574 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-99.16 |
7.13 |
-8.86 |
-0.95 |
0 |
|
|
307583 |
125307578 |
1 |
ON2C26H32 |
AB2C26D32 |
-6.43 |
4.69 |
-9.09 |
-1.16 |
0 |
|
|
307585 |
125307599 |
1 |
N3H25C33 |
A3B25C33 |
181.93 |
4.28 |
-8.15 |
-0.72 |
0 |
|
|
307587 |
125307611 |
1 |
N2O5C15H18 |
A2B5C15D18 |
-183.34 |
3.66 |
-8.66 |
-0.98 |
0 |
|
|
307588 |
125307614 |
1 |
Cl2O2N3C21H21 |
A2B2C3D21E21 |
-9.35 |
5.31 |
-9.12 |
-1.62 |
0 |
|
|
307589 |
125307624 |
1 |
SN2O4C23H24 |
AB2C4D23E24 |
-65.6 |
4.3 |
-8.48 |
-1.82 |
0 |
|
|
307590 |
125307627 |
1 |
N2O4H20C21 |
A2B4C20D21 |
-93.58 |
1.9 |
-8.84 |
-0.93 |
0 |
|
|
307591 |
125307637 |
1 |
OSN6H14C17 |
ABC6D14E17 |
142.35 |
5.52 |
-8.76 |
-1.48 |
0 |
|
|
307592 |
125307639 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-29.26 |
2.49 |
-8.68 |
-0.99 |
0 |
|
|
307593 |
125307649 |
1 |
SN3O4C23H25 |
AB3C4D23E25 |
-103.67 |
4.67 |
-8.49 |
-1.22 |
0 |
|
|
307594 |
125307655 |
2 |
NSO2H6C10 |
ABC2D6E10 |
-10.92 |
3.36 |
-9.02 |
-1.81 |
0 |
|
|
307595 |
125307665 |
1 |
Cl2N2O3H20C24 |
A2B2C3D20E24 |
-9.34 |
3.72 |
-9.16 |
-1.01 |
0 |
|
|
307596 |
125307671 |
1 |
O2N3C27H29 |
A2B3C27D29 |
-7.68 |
3.55 |
-8.92 |
-0.96 |
0 |
|
|
307597 |
125307687 |
1 |
ClFN3O4H25C28 |
ABC3D4E25F28 |
-69.41 |
7.63 |
-8.28 |
-1.12 |
0 |
|
|
307598 |
125307697 |
1 |
ON3H19C23 |
AB3C19D23 |
81.72 |
3.34 |
-8.72 |
-1.47 |
0 |
|
|
307599 |
125307702 |
2 |
ON2C7H7 |
AB2C7D7 |
35.24 |
7.29 |
-9.08 |
-0.83 |
0 |
|
|
307600 |
125307704 |
1 |
N4O4H14C15 |
A4B4C14D15 |
-37.96 |
2.32 |
-9.91 |
-2.44 |
0 |
|
|
307601 |
125307705 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-70.44 |
5.31 |
-8.78 |
-0.79 |
0 |
|
|
307603 |
125307711 |
1 |
BrN2O5H23C27 |
AB2C5D23E27 |
-81.68 |
9.59 |
-8.86 |
-0.9 |
0 |
|
|
307604 |
125307717 |
2 |
NO3H12C13 |
AB3C12D13 |
-158.83 |
7.54 |
-9.27 |
-1.36 |
0 |
|
|
307605 |
125307718 |
2 |
NO3H12C13 |
AB3C12D13 |
-149.2 |
10.22 |
-9.26 |
-1.49 |
0 |
|
|
307606 |
125307724 |
1 |
SO3N5H15C17 |
AB3C5D15E17 |
19.44 |
10.61 |
-9.57 |
-1.37 |
0 |
|
|
307607 |
125307726 |
1 |
N2O3H28C32 |
A2B3C28D32 |
30.63 |
4.83 |
-8.19 |
-1.25 |
0 |
|
|
307608 |
125307728 |
1 |
N2O3H28C32 |
A2B3C28D32 |
33.4 |
4.32 |
-8.18 |
-1.25 |
0 |
|
|
307609 |
125307731 |
1 |
O3N4C23H24 |
A3B4C23D24 |
-25.95 |
4.57 |
-9.14 |
-1.22 |
0 |
|
|
307610 |
125307737 |
1 |
BrN5H10C17 |
AB5C10D17 |
184.46 |
2.9 |
-9.26 |
-1.97 |
0 |
|
|
307611 |
125307741 |
1 |
FN3O3H8C11 |
AB3C3D8E11 |
-112.35 |
6.23 |
-10.5 |
-1.39 |
0 |
|
|
307612 |
125307742 |
1 |
ClON4H25C27 |
ABC4D25E27 |
76.26 |
4.7 |
-9.03 |
-1.44 |
0 |
|
|
307613 |
125307744 |
1 |
O5N6C22H24 |
A5B6C22D24 |
-114.84 |
4.47 |
-8.97 |
-0.94 |
0 |
|
|
307614 |
125307750 |
1 |
SN4O4C20H24 |
AB4C4D20E24 |
-85.95 |
5.65 |
-9.03 |
-1.78 |
0 |
|
|
307615 |
125307752 |
1 |
SN6C9H10 |
AB6C9D10 |
167.87 |
1.81 |
-8.84 |
-1.38 |
0 |
|
|
307616 |
125307763 |
1 |
N3O5C26H27 |
A3B5C26D27 |
-78.07 |
3.16 |
-8.3 |
-1.13 |
0 |
|
|
307617 |
125307764 |
1 |
N3O5C26H27 |
A3B5C26D27 |
-78.3 |
4.27 |
-8.41 |
-1.15 |
0 |
|
|
307618 |
125307775 |
1 |
N3O5C25H31 |
A3B5C25D31 |
-117.36 |
4.29 |
-8.83 |
-1.41 |
0 |
|
|
307619 |
125307777 |
1 |
S2N4O5C14H16 |
A2B4C5D14E16 |
-145.7 |
6.37 |
-9.67 |
-1.49 |
0 |
|
|
307620 |
125307779 |
1 |
N3O3H19C20 |
A3B3C19D20 |
9.49 |
6.33 |
-9.0 |
-1.1 |
0 |
|
|
307621 |
125307782 |
1 |
ClN3O3C19H24 |
AB3C3D19E24 |
-92.97 |
3.25 |
-9.18 |
-1.43 |
0 |
|
|
307622 |
125307783 |
1 |
ClN3O3C19H24 |
AB3C3D19E24 |
-92.87 |
3.13 |
-9.18 |
-1.42 |
0 |
|
|
307623 |
125307806 |
1 |
N2O2C21H22 |
A2B2C21D22 |
-1.4 |
3.21 |
-8.76 |
-1.77 |
0 |
|
|
307624 |
125307807 |
2 |
O2C11H18 |
A2B11C18 |
-229.52 |
2.8 |
-10.23 |
-0.02 |
0 |
|
|
307625 |
125307810 |
2 |
OC7H11 |
AB7C11 |
-78.75 |
3.2 |
-9.95 |
-0.18 |
0 |